ChemLookup

Friday, January 27, 2012

http://ChemLookup.com Compounds

CAS RN: 147217-61-6
CAS Name: 3-benzamido-1-(2-chloroethyl)-1-nitrosourea
OPENEYE Name: 3-benzamido-1-(2-chloroethyl)-1-nitroso-urea
IUPAC Name: 3-benzamido-1-(2-chloroethyl)-1-nitrosourea
SYSTEMATIC NAME: 3-benzamido-1-(2-chloroethyl)-1-nitroso-urea
MOLECULAR FORMULA: C10H11ClN4O3
MOLECULAR WEIGHT: 270.67234
SMILES: C1=CC=C(C=C1)C(=O)NNC(=O)N(CCCl)N=O
Structure:

CAS RN: 147160-52-9
CAS Name: 3-methyl-N-[4-[[(3-methyl-1-pyrazolyl)-oxomethyl]amino]butyl]-1-pyrazolecarboxamide
OPENEYE Name: 3-methyl-N-[4-[(3-methylpyrazole-1-carbonyl)amino]butyl]pyrazole-1-carboxamide
IUPAC Name: 3-methyl-N-[4-[(3-methylpyrazole-1-carbonyl)amino]butyl]pyrazole-1-carboxamide
SYSTEMATIC NAME: 3-methyl-N-[4-[(3-methylpyrazol-1-yl)carbonylamino]butyl]pyrazole-1-carboxamide
MOLECULAR FORMULA: C14H20N6O2
MOLECULAR WEIGHT: 304.3476
SMILES: CC1=NN(C=C1)C(=O)NCCCCNC(=O)N2C=CC(=N2)C
Structure:

CAS RN: 147160-51-8
CAS Name: 3-methyl-N-[6-[[(3-methyl-1-pyrazolyl)-oxomethyl]amino]hexyl]-1-pyrazolecarboxamide
OPENEYE Name: 3-methyl-N-[6-[(3-methylpyrazole-1-carbonyl)amino]hexyl]pyrazole-1-carboxamide
IUPAC Name: 3-methyl-N-[6-[(3-methylpyrazole-1-carbonyl)amino]hexyl]pyrazole-1-carboxamide
SYSTEMATIC NAME: 3-methyl-N-[6-[(3-methylpyrazol-1-yl)carbonylamino]hexyl]pyrazole-1-carboxamide
MOLECULAR FORMULA: C16H24N6O2
MOLECULAR WEIGHT: 332.40076
SMILES: CC1=NN(C=C1)C(=O)NCCCCCCNC(=O)N2C=CC(=N2)C
Structure:

CAS RN: 147046-22-8
CAS Name: [4-[[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-2-oxanyl]oxy]phenyl]-(4-nitrophenyl)methanone
OPENEYE Name: [4-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxyphenyl]-(4-nitrophenyl)methanone
IUPAC Name: [4-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxyphenyl]-(4-nitrophenyl)methanone
SYSTEMATIC NAME: [4-[(2S,3R,4R,5S,6R)-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-3,4-bis(oxidanyl)oxan-2-yl]oxyphenyl]-(4-nitrophenyl)methanone
MOLECULAR FORMULA: C25H29NO14
MOLECULAR WEIGHT: 567.49606
SMILES: C1=CC(=CC=C1C(=O)C2=CC=C(C=C2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O[C@H]4[C@@H]([C@H]([C@H]([C@H](O4)CO)O)O)O)O)O)[N+](=O)[O-]
Structure:

CAS RN: 147029-86-5
CAS Name: (2S,3R,4S,5R)-2-[4-[(4-methoxyphenyl)methyl]phenoxy]oxane-3,4,5-triol
OPENEYE Name: (2S,3R,4S,5R)-2-[4-[(4-methoxyphenyl)methyl]phenoxy]tetrahydropyran-3,4,5-triol
IUPAC Name: (2S,3R,4S,5R)-2-[4-[(4-methoxyphenyl)methyl]phenoxy]oxane-3,4,5-triol
SYSTEMATIC NAME: (2S,3R,4S,5R)-2-[4-[(4-methoxyphenyl)methyl]phenoxy]oxane-3,4,5-triol
MOLECULAR FORMULA: C19H22O6
MOLECULAR WEIGHT: 346.37438
SMILES: COC1=CC=C(C=C1)CC2=CC=C(C=C2)O[C@H]3[C@@H]([C@H]([C@@H](CO3)O)O)O
Structure:

CAS RN: 147029-85-4
CAS Name: (2S,3R,4S,5R)-2-[4-[(2-chlorophenyl)methyl]phenoxy]oxane-3,4,5-triol
OPENEYE Name: (2S,3R,4S,5R)-2-[4-[(2-chlorophenyl)methyl]phenoxy]tetrahydropyran-3,4,5-triol
IUPAC Name: (2S,3R,4S,5R)-2-[4-[(2-chlorophenyl)methyl]phenoxy]oxane-3,4,5-triol
SYSTEMATIC NAME: (2S,3R,4S,5R)-2-[4-[(2-chlorophenyl)methyl]phenoxy]oxane-3,4,5-triol
MOLECULAR FORMULA: C18H19ClO5
MOLECULAR WEIGHT: 350.79346
SMILES: C1[C@H]([C@@H]([C@H]([C@@H](O1)OC2=CC=C(C=C2)CC3=CC=CC=C3Cl)O)O)O
Structure:

CAS RN: 147029-84-3
CAS Name: (2S,3R,4S,5R)-2-[4-[(2,4-dichlorophenyl)methyl]phenoxy]oxane-3,4,5-triol
OPENEYE Name: (2S,3R,4S,5R)-2-[4-[(2,4-dichlorophenyl)methyl]phenoxy]tetrahydropyran-3,4,5-triol
IUPAC Name: (2S,3R,4S,5R)-2-[4-[(2,4-dichlorophenyl)methyl]phenoxy]oxane-3,4,5-triol
SYSTEMATIC NAME: (2S,3R,4S,5R)-2-[4-[(2,4-dichlorophenyl)methyl]phenoxy]oxane-3,4,5-triol
MOLECULAR FORMULA: C18H18Cl2O5
MOLECULAR WEIGHT: 385.23852
SMILES: C1[C@H]([C@@H]([C@H]([C@@H](O1)OC2=CC=C(C=C2)CC3=C(C=C(C=C3)Cl)Cl)O)O)O
Structure:

CAS RN: 147029-83-2
CAS Name: (2S,3R,4S,5R)-2-[3-[(4-chlorophenyl)methyl]phenoxy]oxane-3,4,5-triol
OPENEYE Name: (2S,3R,4S,5R)-2-[3-[(4-chlorophenyl)methyl]phenoxy]tetrahydropyran-3,4,5-triol
IUPAC Name: (2S,3R,4S,5R)-2-[3-[(4-chlorophenyl)methyl]phenoxy]oxane-3,4,5-triol
SYSTEMATIC NAME: (2S,3R,4S,5R)-2-[3-[(4-chlorophenyl)methyl]phenoxy]oxane-3,4,5-triol
MOLECULAR FORMULA: C18H19ClO5
MOLECULAR WEIGHT: 350.79346
SMILES: C1[C@H]([C@@H]([C@H]([C@@H](O1)OC2=CC=CC(=C2)CC3=CC=C(C=C3)Cl)O)O)O
Structure:

CAS RN: 147029-82-1
CAS Name: (2S,3R,4S,5R)-2-[3-(phenylmethyl)phenoxy]oxane-3,4,5-triol
OPENEYE Name: (2S,3R,4S,5R)-2-(3-benzylphenoxy)tetrahydropyran-3,4,5-triol
IUPAC Name: (2S,3R,4S,5R)-2-(3-benzylphenoxy)oxane-3,4,5-triol
SYSTEMATIC NAME: (2S,3R,4S,5R)-2-[3-(phenylmethyl)phenoxy]oxane-3,4,5-triol
MOLECULAR FORMULA: C18H20O5
MOLECULAR WEIGHT: 316.3484
SMILES: C1[C@H]([C@@H]([C@H]([C@@H](O1)OC2=CC=CC(=C2)CC3=CC=CC=C3)O)O)O
Structure:

CAS RN: 147029-75-2
CAS Name: (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[4-[(4-nitrophenyl)-oxomethyl]phenoxy]-2-oxanecarboxylic acid
OPENEYE Name: (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[4-(4-nitrobenzoyl)phenoxy]tetrahydropyran-2-carboxylic acid
IUPAC Name: (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[4-(4-nitrobenzoyl)phenoxy]oxane-2-carboxylic acid
SYSTEMATIC NAME: (2S,3S,4S,5R,6S)-6-[4-(4-nitrophenyl)carbonylphenoxy]-3,4,5-tris(oxidanyl)oxane-2-carboxylic acid
MOLECULAR FORMULA: C19H17NO10
MOLECULAR WEIGHT: 419.33898
SMILES: C1=CC(=CC=C1C(=O)C2=CC=C(C=C2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)O)O)O)O)[N+](=O)[O-]
Structure:

CAS RN: 147029-74-1
CAS Name: [4-[[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-2-oxanyl]oxy]phenyl]-(4-nitrophenyl)methanone
OPENEYE Name: [4-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxyphenyl]-(4-nitrophenyl)methanone
IUPAC Name: [4-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxyphenyl]-(4-nitrophenyl)methanone
SYSTEMATIC NAME: [4-[(2S,3R,4R,5S,6R)-6-(hydroxymethyl)-5-[(2R,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-3,4-bis(oxidanyl)oxan-2-yl]oxyphenyl]-(4-nitrophenyl)methanone
MOLECULAR FORMULA: C25H29NO14
MOLECULAR WEIGHT: 567.49606
SMILES: C1=CC(=CC=C1C(=O)C2=CC=C(C=C2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O[C@@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O)[N+](=O)[O-]
Structure:

CAS RN: 147029-72-9
CAS Name: (4-nitrophenyl)-[4-[[(2R,3R,4S,5R)-3,4,5-trihydroxy-2-oxanyl]oxy]phenyl]methanone
OPENEYE Name: (4-nitrophenyl)-[4-[(2R,3R,4S,5R)-3,4,5-trihydroxytetrahydropyran-2-yl]oxyphenyl]methanone
IUPAC Name: (4-nitrophenyl)-[4-[(2R,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyphenyl]methanone
SYSTEMATIC NAME: (4-nitrophenyl)-[4-[(2R,3R,4S,5R)-3,4,5-tris(oxidanyl)oxan-2-yl]oxyphenyl]methanone
MOLECULAR FORMULA: C18H17NO8
MOLECULAR WEIGHT: 375.32948
SMILES: C1[C@H]([C@@H]([C@H]([C@H](O1)OC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-])O)O)O
Structure:

CAS RN: 147029-71-8
CAS Name: (4-nitrophenyl)-[4-[[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]phenyl]methanone
OPENEYE Name: (4-nitrophenyl)-[4-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxyphenyl]methanone
IUPAC Name: (4-nitrophenyl)-[4-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methanone
SYSTEMATIC NAME: [4-[(2S,3S,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxyphenyl]-(4-nitrophenyl)methanone
MOLECULAR FORMULA: C19H19NO9
MOLECULAR WEIGHT: 405.35546
SMILES: C1=CC(=CC=C1C(=O)C2=CC=C(C=C2)O[C@H]3[C@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)[N+](=O)[O-]
Structure:

CAS RN: 147029-70-7
CAS Name: (4-nitrophenyl)-[4-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]phenyl]methanone
OPENEYE Name: (4-nitrophenyl)-[4-[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxyphenyl]methanone
IUPAC Name: (4-nitrophenyl)-[4-[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methanone
SYSTEMATIC NAME: [4-[(2R,3S,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxyphenyl]-(4-nitrophenyl)methanone
MOLECULAR FORMULA: C19H19NO9
MOLECULAR WEIGHT: 405.35546
SMILES: C1=CC(=CC=C1C(=O)C2=CC=C(C=C2)O[C@@H]3[C@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)[N+](=O)[O-]
Structure:

Thursday, January 26, 2012

http://ChemLookup.com Compounds

CAS RN: 147394-58-9
CAS Name: (2-fluorophenyl)-(2-methyl-2,3-dihydrobenzofuran-5-yl)methanone
OPENEYE Name: (2-fluorophenyl)-(2-methyl-2,3-dihydrobenzofuran-5-yl)methanone
IUPAC Name: (2-fluorophenyl)-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanone
SYSTEMATIC NAME: (2-fluorophenyl)-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanone
MOLECULAR FORMULA: C16H13FO2
MOLECULAR WEIGHT: 256.271623
SMILES: CC1CC2=C(O1)C=CC(=C2)C(=O)C3=CC=CC=C3F
Structure:

CAS RN: 147394-57-8
CAS Name: (2-methyl-2,3-dihydrobenzofuran-5-yl)-phenylmethanone
OPENEYE Name: (2-methyl-2,3-dihydrobenzofuran-5-yl)-phenyl-methanone
IUPAC Name: (2-methyl-2,3-dihydro-1-benzofuran-5-yl)-phenylmethanone
SYSTEMATIC NAME: (2-methyl-2,3-dihydro-1-benzofuran-5-yl)-phenyl-methanone
MOLECULAR FORMULA: C16H14O2
MOLECULAR WEIGHT: 238.28116
SMILES: CC1CC2=C(O1)C=CC(=C2)C(=O)C3=CC=CC=C3
Structure:

CAS RN: 147394-49-8
CAS Name: (2-fluorophenyl)-(2,3,4,5-tetrahydro-1-benzoxepin-7-yl)methanone
OPENEYE Name: (2-fluorophenyl)-(2,3,4,5-tetrahydro-1-benzoxepin-7-yl)methanone
IUPAC Name: (2-fluorophenyl)-(2,3,4,5-tetrahydro-1-benzoxepin-7-yl)methanone
SYSTEMATIC NAME: (2-fluorophenyl)-(2,3,4,5-tetrahydro-1-benzoxepin-7-yl)methanone
MOLECULAR FORMULA: C17H15FO2
MOLECULAR WEIGHT: 270.298203
SMILES: C1CCOC2=C(C1)C=C(C=C2)C(=O)C3=CC=CC=C3F
Structure:

CAS RN: 147394-48-7
CAS Name: phenyl(2,3,4,5-tetrahydro-1-benzoxepin-7-yl)methanone
OPENEYE Name: phenyl(2,3,4,5-tetrahydro-1-benzoxepin-7-yl)methanone
IUPAC Name: phenyl(2,3,4,5-tetrahydro-1-benzoxepin-7-yl)methanone
SYSTEMATIC NAME: phenyl(2,3,4,5-tetrahydro-1-benzoxepin-7-yl)methanone
MOLECULAR FORMULA: C17H16O2
MOLECULAR WEIGHT: 252.30774
SMILES: C1CCOC2=C(C1)C=C(C=C2)C(=O)C3=CC=CC=C3
Structure:

CAS RN: 147384-57-4
CAS Name: acetic acid [(2S,3R,4S)-2-[(3R,4aR,6aS,12S,12aS,12bR)-12-hydroxy-3-(2-hydroxypropan-2-yl)-6a,12b-dimethyl-8,11-dioxo-1,2,3,4a,5,6,12,12a-octahydropyrano[3,2-a]xanthen-9-yl]-4-methylhexan-3-yl] ester
OPENEYE Name: [(1R,2S)-1-[(1S)-1-[(3R,4aR,6aS,12S,12aS,12bR)-12-hydroxy-3-(1-hydroxy-1-methyl-ethyl)-6a,12b-dimethyl-8,11-dioxo-1,2,3,4a,5,6,12,12a-octahydropyrano[3,2-a]xanthen-9-yl]ethyl]-2-methyl-butyl] acetate
IUPAC Name: [(2S,3R,4S)-2-[(3R,4aR,6aS,12S,12aS,12bR)-12-hydroxy-3-(2-hydroxypropan-2-yl)-6a,12b-dimethyl-8,11-dioxo-1,2,3,4a,5,6,12,12a-octahydropyrano[3,2-a]xanthen-9-yl]-4-methylhexan-3-yl] acetate
SYSTEMATIC NAME: [(2S,3R,4S)-2-[(3R,4aR,6aS,12S,12aS,12bR)-6a,12b-dimethyl-12-oxidanyl-8,11-bis(oxidanylidene)-3-(2-oxidanylpropan-2-yl)-1,2,3,4a,5,6,12,12a-octahydropyrano[3,2-a]xanthen-9-yl]-4-methyl-hexan-3-yl] ethanoate
MOLECULAR FORMULA: C30H44O8
MOLECULAR WEIGHT: 532.66556
SMILES: CC[C@H](C)[C@H]([C@@H](C)C1=CC(=O)C2=C(C1=O)O[C@]3(CC[C@@H]4[C@@]([C@H]3[C@@H]2O)(CC[C@@H](O4)C(C)(C)O)C)C)OC(=O)C
Structure:

CAS RN: 147359-16-8
CAS Name: 4-chloro-6-methoxy-1-nitrosoindole
OPENEYE Name: 4-chloro-6-methoxy-1-nitroso-indole
IUPAC Name: 4-chloro-6-methoxy-1-nitrosoindole
SYSTEMATIC NAME: 4-chloranyl-6-methoxy-1-nitroso-indole
MOLECULAR FORMULA: C9H7ClN2O2
MOLECULAR WEIGHT: 210.61708
SMILES: COC1=CC(=C2C=CN(C2=C1)N=O)Cl
Structure:

CAS RN: 147352-77-0
CAS Name: 1-phenyl-2-(2,3,3-trimethyl-1-cyclopentenyl)ethanamine
OPENEYE Name: 1-phenyl-2-(2,3,3-trimethylcyclopenten-1-yl)ethanamine
IUPAC Name: 1-phenyl-2-(2,3,3-trimethylcyclopenten-1-yl)ethanamine
SYSTEMATIC NAME: 1-phenyl-2-(2,3,3-trimethylcyclopenten-1-yl)ethanamine
MOLECULAR FORMULA: C16H23N
MOLECULAR WEIGHT: 229.36052
SMILES: CC1=C(CCC1(C)C)CC(C2=CC=CC=C2)N
Structure:

CAS RN: 147310-67-6
CAS Name: zinc; (2S)-2-amino-5-(diaminomethylideneamino)pentanoic acid; 2,3,4,5,6-pentahydroxyhexanoate
OPENEYE Name: zinc; (2S)-2-amino-5-guanidino-pentanoic acid; 2,3,4,5,6-pentahydroxyhexanoate
IUPAC Name: zinc; (2S)-2-amino-5-(diaminomethylideneamino)pentanoic acid; 2,3,4,5,6-pentahydroxyhexanoate
SYSTEMATIC NAME: zinc; (2S)-2-azanyl-5-[bis(azanyl)methylideneamino]pentanoic acid; 2,3,4,5,6-pentakis(oxidanyl)hexanoate
MOLECULAR FORMULA: C18H36N4O16Zn
MOLECULAR WEIGHT: 629.90464
SMILES: C(C[C@@H](C(=O)O)N)CN=C(N)N.C(C(C(C(C(C(=O)[O-])O)O)O)O)O.C(C(C(C(C(C(=O)[O-])O)O)O)O)O.[Zn+2]
Structure:

CAS RN: 147297-18-5
CAS Name: 5,6-dimethyl-2-[4-(4-phenyl-1-piperazinyl)butyl]pyrrolo[3,4-c]pyridine-1,3,4-trione
OPENEYE Name: 5,6-dimethyl-2-[4-(4-phenylpiperazin-1-yl)butyl]pyrrolo[3,4-c]pyridine-1,3,4-trione
IUPAC Name: 5,6-dimethyl-2-[4-(4-phenylpiperazin-1-yl)butyl]pyrrolo[3,4-c]pyridine-1,3,4-trione
SYSTEMATIC NAME: 5,6-dimethyl-2-[4-(4-phenylpiperazin-1-yl)butyl]pyrrolo[3,4-c]pyridine-1,3,4-trione
MOLECULAR FORMULA: C23H28N4O3
MOLECULAR WEIGHT: 408.49342
SMILES: CC1=CC2=C(C(=O)N1C)C(=O)N(C2=O)CCCCN3CCN(CC3)C4=CC=CC=C4
Structure:

CAS RN: 147297-09-4
CAS Name: 2-[[4-(3-chlorophenyl)-1-piperazinyl]methyl]-5,6-dimethylpyrrolo[3,4-c]pyridine-1,3,4-trione
OPENEYE Name: 2-[[4-(3-chlorophenyl)piperazin-1-yl]methyl]-5,6-dimethyl-pyrrolo[3,4-c]pyridine-1,3,4-trione
IUPAC Name: 2-[[4-(3-chlorophenyl)piperazin-1-yl]methyl]-5,6-dimethylpyrrolo[3,4-c]pyridine-1,3,4-trione
SYSTEMATIC NAME: 2-[[4-(3-chlorophenyl)piperazin-1-yl]methyl]-5,6-dimethyl-pyrrolo[3,4-c]pyridine-1,3,4-trione
MOLECULAR FORMULA: C20H21ClN4O3
MOLECULAR WEIGHT: 400.85874
SMILES: CC1=CC2=C(C(=O)N1C)C(=O)N(C2=O)CN3CCN(CC3)C4=CC(=CC=C4)Cl
Structure:

CAS RN: 147297-08-3
CAS Name: 2-[[4-(2-chlorophenyl)-1-piperazinyl]methyl]-5,6-dimethylpyrrolo[3,4-c]pyridine-1,3,4-trione
OPENEYE Name: 2-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]-5,6-dimethyl-pyrrolo[3,4-c]pyridine-1,3,4-trione
IUPAC Name: 2-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]-5,6-dimethylpyrrolo[3,4-c]pyridine-1,3,4-trione
SYSTEMATIC NAME: 2-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]-5,6-dimethyl-pyrrolo[3,4-c]pyridine-1,3,4-trione
MOLECULAR FORMULA: C20H21ClN4O3
MOLECULAR WEIGHT: 400.85874
SMILES: CC1=CC2=C(C(=O)N1C)C(=O)N(C2=O)CN3CCN(CC3)C4=CC=CC=C4Cl
Structure:

CAS RN: 147297-04-9
CAS Name: 1-[3-[4-(2-chlorophenyl)-1-piperazinyl]propyl]-7-methyl-2,4-dioxo-3-phenyl-5-pyrido[2,3-d]pyrimidinecarboxylic acid ethyl ester
OPENEYE Name: ethyl 1-[3-[4-(2-chlorophenyl)piperazin-1-yl]propyl]-7-methyl-2,4-dioxo-3-phenyl-pyrido[2,3-d]pyrimidine-5-carboxylate
IUPAC Name: ethyl 1-[3-[4-(2-chlorophenyl)piperazin-1-yl]propyl]-7-methyl-2,4-dioxo-3-phenylpyrido[2,3-d]pyrimidine-5-carboxylate
SYSTEMATIC NAME: ethyl 1-[3-[4-(2-chlorophenyl)piperazin-1-yl]propyl]-7-methyl-2,4-bis(oxidanylidene)-3-phenyl-pyrido[2,3-d]pyrimidine-5-carboxylate
MOLECULAR FORMULA: C30H32ClN5O4
MOLECULAR WEIGHT: 562.05918
SMILES: CCOC(=O)C1=CC(=NC2=C1C(=O)N(C(=O)N2CCCN3CCN(CC3)C4=CC=CC=C4Cl)C5=CC=CC=C5)C
Structure:

CAS RN: 147297-03-8
CAS Name: 7-methyl-2,4-dioxo-3-phenyl-1-[3-(4-phenyl-1-piperazinyl)propyl]-5-pyrido[2,3-d]pyrimidinecarboxylic acid ethyl ester
OPENEYE Name: ethyl 7-methyl-2,4-dioxo-3-phenyl-1-[3-(4-phenylpiperazin-1-yl)propyl]pyrido[2,3-d]pyrimidine-5-carboxylate
IUPAC Name: ethyl 7-methyl-2,4-dioxo-3-phenyl-1-[3-(4-phenylpiperazin-1-yl)propyl]pyrido[2,3-d]pyrimidine-5-carboxylate
SYSTEMATIC NAME: ethyl 7-methyl-2,4-bis(oxidanylidene)-3-phenyl-1-[3-(4-phenylpiperazin-1-yl)propyl]pyrido[2,3-d]pyrimidine-5-carboxylate
MOLECULAR FORMULA: C30H33N5O4
MOLECULAR WEIGHT: 527.61412
SMILES: CCOC(=O)C1=CC(=NC2=C1C(=O)N(C(=O)N2CCCN3CCN(CC3)C4=CC=CC=C4)C5=CC=CC=C5)C
Structure:

CAS RN: 147296-98-8
CAS Name: 2-[3-[4-(3-chlorophenyl)-1-piperazinyl]propylthio]-3,7-dimethyl-4-oxo-5-pyrido[2,3-d]pyrimidinecarboxylic acid ethyl ester
OPENEYE Name: ethyl 2-[3-[4-(3-chlorophenyl)piperazin-1-yl]propylsulfanyl]-3,7-dimethyl-4-oxo-pyrido[2,3-d]pyrimidine-5-carboxylate
IUPAC Name: ethyl 2-[3-[4-(3-chlorophenyl)piperazin-1-yl]propylsulfanyl]-3,7-dimethyl-4-oxopyrido[2,3-d]pyrimidine-5-carboxylate
SYSTEMATIC NAME: ethyl 2-[3-[4-(3-chlorophenyl)piperazin-1-yl]propylsulfanyl]-3,7-dimethyl-4-oxidanylidene-pyrido[2,3-d]pyrimidine-5-carboxylate
MOLECULAR FORMULA: C25H30ClN5O3S
MOLECULAR WEIGHT: 516.0554
SMILES: CCOC(=O)C1=CC(=NC2=C1C(=O)N(C(=N2)SCCCN3CCN(CC3)C4=CC(=CC=C4)Cl)C)C
Structure:

CAS RN: 147296-97-7
CAS Name: 2-[3-[4-(2-chlorophenyl)-1-piperazinyl]propylthio]-3,7-dimethyl-4-oxo-5-pyrido[2,3-d]pyrimidinecarboxylic acid ethyl ester
OPENEYE Name: ethyl 2-[3-[4-(2-chlorophenyl)piperazin-1-yl]propylsulfanyl]-3,7-dimethyl-4-oxo-pyrido[2,3-d]pyrimidine-5-carboxylate
IUPAC Name: ethyl 2-[3-[4-(2-chlorophenyl)piperazin-1-yl]propylsulfanyl]-3,7-dimethyl-4-oxopyrido[2,3-d]pyrimidine-5-carboxylate
SYSTEMATIC NAME: ethyl 2-[3-[4-(2-chlorophenyl)piperazin-1-yl]propylsulfanyl]-3,7-dimethyl-4-oxidanylidene-pyrido[2,3-d]pyrimidine-5-carboxylate
MOLECULAR FORMULA: C25H30ClN5O3S
MOLECULAR WEIGHT: 516.0554
SMILES: CCOC(=O)C1=CC(=NC2=C1C(=O)N(C(=N2)SCCCN3CCN(CC3)C4=CC=CC=C4Cl)C)C
Structure:

CAS RN: 147296-96-6
CAS Name: 3,7-dimethyl-4-oxo-2-[3-(4-phenyl-1-piperazinyl)propylthio]-5-pyrido[2,3-d]pyrimidinecarboxylic acid ethyl ester
OPENEYE Name: ethyl 3,7-dimethyl-4-oxo-2-[3-(4-phenylpiperazin-1-yl)propylsulfanyl]pyrido[2,3-d]pyrimidine-5-carboxylate
IUPAC Name: ethyl 3,7-dimethyl-4-oxo-2-[3-(4-phenylpiperazin-1-yl)propylsulfanyl]pyrido[2,3-d]pyrimidine-5-carboxylate
SYSTEMATIC NAME: ethyl 3,7-dimethyl-4-oxidanylidene-2-[3-(4-phenylpiperazin-1-yl)propylsulfanyl]pyrido[2,3-d]pyrimidine-5-carboxylate
MOLECULAR FORMULA: C25H31N5O3S
MOLECULAR WEIGHT: 481.61034
SMILES: CCOC(=O)C1=CC(=NC2=C1C(=O)N(C(=N2)SCCCN3CCN(CC3)C4=CC=CC=C4)C)C
Structure:

CAS RN: 147296-94-4
CAS Name: 7-methyl-4-oxo-3-phenyl-2-[3-(4-phenyl-1-piperazinyl)propylthio]-5-pyrido[2,3-d]pyrimidinecarboxylic acid ethyl ester
OPENEYE Name: ethyl 7-methyl-4-oxo-3-phenyl-2-[3-(4-phenylpiperazin-1-yl)propylsulfanyl]pyrido[2,3-d]pyrimidine-5-carboxylate
IUPAC Name: ethyl 7-methyl-4-oxo-3-phenyl-2-[3-(4-phenylpiperazin-1-yl)propylsulfanyl]pyrido[2,3-d]pyrimidine-5-carboxylate
SYSTEMATIC NAME: ethyl 7-methyl-4-oxidanylidene-3-phenyl-2-[3-(4-phenylpiperazin-1-yl)propylsulfanyl]pyrido[2,3-d]pyrimidine-5-carboxylate
MOLECULAR FORMULA: C30H33N5O3S
MOLECULAR WEIGHT: 543.67972
SMILES: CCOC(=O)C1=CC(=NC2=C1C(=O)N(C(=N2)SCCCN3CCN(CC3)C4=CC=CC=C4)C5=CC=CC=C5)C
Structure:

CAS RN: 147249-34-1
CAS Name: 2-hydroxybenzoic acid (2-methyl-4-oxo-3-pyranyl) ester
OPENEYE Name: (2-methyl-4-oxo-pyran-3-yl) 2-hydroxybenzoate
IUPAC Name: (2-methyl-4-oxopyran-3-yl) 2-hydroxybenzoate
SYSTEMATIC NAME: (2-methyl-4-oxidanylidene-pyran-3-yl) 2-oxidanylbenzoate
MOLECULAR FORMULA: C13H10O5
MOLECULAR WEIGHT: 246.2155
SMILES: CC1=C(C(=O)C=CO1)OC(=O)C2=CC=CC=C2O
Structure:

CAS RN: 147241-85-8
CAS Name: N,N-dimethyl-2-[[2-methyl-4-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-1-benzopyran-7-yl]oxy]ethanamine
OPENEYE Name: N,N-dimethyl-2-[2-methyl-4-[3-(trifluoromethyl)phenyl]chroman-7-yl]oxy-ethanamine
IUPAC Name: N,N-dimethyl-2-[[2-methyl-4-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-chromen-7-yl]oxy]ethanamine
SYSTEMATIC NAME: N,N-dimethyl-2-[[2-methyl-4-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-chromen-7-yl]oxy]ethanamine
MOLECULAR FORMULA: C21H24F3NO2
MOLECULAR WEIGHT: 379.41597
SMILES: CC1CC(C2=C(O1)C=C(C=C2)OCCN(C)C)C3=CC(=CC=C3)C(F)(F)F
Structure:

CAS RN: 147217-65-0
CAS Name: 1-(2-chloroethyl)-3-[[(4-chlorophenyl)-oxomethyl]amino]-1-nitrosourea
OPENEYE Name: 3-[(4-chlorobenzoyl)amino]-1-(2-chloroethyl)-1-nitroso-urea
IUPAC Name: 3-[(4-chlorobenzoyl)amino]-1-(2-chloroethyl)-1-nitrosourea
SYSTEMATIC NAME: 1-(2-chloroethyl)-3-[(4-chlorophenyl)carbonylamino]-1-nitroso-urea
MOLECULAR FORMULA: C10H10Cl2N4O3
MOLECULAR WEIGHT: 305.1174
SMILES: C1=CC(=CC=C1C(=O)NNC(=O)N(CCCl)N=O)Cl
Structure:

CAS RN: 147217-64-9
CAS Name: 3-[[(4-aminophenyl)-oxomethyl]amino]-1-(2-chloroethyl)-1-nitrosourea
OPENEYE Name: 3-[(4-aminobenzoyl)amino]-1-(2-chloroethyl)-1-nitroso-urea
IUPAC Name: 3-[(4-aminobenzoyl)amino]-1-(2-chloroethyl)-1-nitrosourea
SYSTEMATIC NAME: 3-[(4-aminophenyl)carbonylamino]-1-(2-chloroethyl)-1-nitroso-urea
MOLECULAR FORMULA: C10H12ClN5O3
MOLECULAR WEIGHT: 285.68698
SMILES: C1=CC(=CC=C1C(=O)NNC(=O)N(CCCl)N=O)N
Structure:

CAS RN: 147217-63-8
CAS Name: 1-(2-chloroethyl)-3-[[(2-hydroxyphenyl)-oxomethyl]amino]-1-nitrosourea
OPENEYE Name: 1-(2-chloroethyl)-3-[(2-hydroxybenzoyl)amino]-1-nitroso-urea
IUPAC Name: 1-(2-chloroethyl)-3-[(2-hydroxybenzoyl)amino]-1-nitrosourea
SYSTEMATIC NAME: 1-(2-chloroethyl)-3-[(2-hydroxyphenyl)carbonylamino]-1-nitroso-urea
MOLECULAR FORMULA: C10H11ClN4O4
MOLECULAR WEIGHT: 286.67174
SMILES: C1=CC=C(C(=C1)C(=O)NNC(=O)N(CCCl)N=O)O
Structure:

CAS RN: 147217-62-7
CAS Name: 1-(2-chloroethyl)-1-nitroso-3-[(1-oxo-2-phenylethyl)amino]urea
OPENEYE Name: 1-(2-chloroethyl)-1-nitroso-3-[(2-phenylacetyl)amino]urea
IUPAC Name: 1-(2-chloroethyl)-1-nitroso-3-[(2-phenylacetyl)amino]urea
SYSTEMATIC NAME: 1-(2-chloroethyl)-1-nitroso-3-(2-phenylethanoylamino)urea
MOLECULAR FORMULA: C11H13ClN4O3
MOLECULAR WEIGHT: 284.69892
SMILES: C1=CC=C(C=C1)CC(=O)NNC(=O)N(CCCl)N=O
Structure:

http://ChemLookup.com Compounds

CAS RN: 147920-25-0
CAS Name: (2R,3S,4R,5R,6S)-4,5-diamino-6-[(1R,2R,4S,5S)-2,4-diamino-5-[[(2R,3R,6S)-3-amino-6-(aminomethyl)-2-oxanyl]oxy]cyclohexyl]oxy-2-(hydroxymethyl)-3-oxanol
OPENEYE Name: (2R,3S,4R,5R,6S)-4,5-diamino-6-[(1R,2R,4S,5S)-2,4-diamino-5-[(2R,3R,6S)-3-amino-6-(aminomethyl)tetrahydropyran-2-yl]oxy-cyclohexoxy]-2-(hydroxymethyl)tetrahydropyran-3-ol
IUPAC Name: (2R,3S,4R,5R,6S)-4,5-diamino-6-[(1R,2R,4S,5S)-2,4-diamino-5-[(2R,3R,6S)-3-amino-6-(aminomethyl)oxan-2-yl]oxycyclohexyl]oxy-2-(hydroxymethyl)oxan-3-ol
SYSTEMATIC NAME: (2R,3S,4R,5R,6S)-6-[(1R,2R,4S,5S)-5-[(2R,3R,6S)-6-(aminomethyl)-3-azanyl-oxan-2-yl]oxy-2,4-bis(azanyl)cyclohexyl]oxy-4,5-bis(azanyl)-2-(hydroxymethyl)oxan-3-ol
MOLECULAR FORMULA: C18H38N6O6
MOLECULAR WEIGHT: 434.53092
SMILES: C1C[C@H]([C@H](O[C@@H]1CN)O[C@H]2C[C@H]([C@@H](C[C@@H]2N)N)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)N)N)N
Structure:

CAS RN: 147920-24-9
CAS Name: (2R,3S,4R,5R,6S)-4,5-diamino-6-[(1S,2S,3R,4S,6R)-4,6-diamino-3-[[(2R,3R,6S)-3-amino-6-(aminomethyl)-2-oxanyl]oxy]-2-hydroxycyclohexyl]oxy-2-(hydroxymethyl)-3-oxanol
OPENEYE Name: (2R,3S,4R,5R,6S)-4,5-diamino-6-[(1S,2S,3R,4S,6R)-4,6-diamino-3-[(2R,3R,6S)-3-amino-6-(aminomethyl)tetrahydropyran-2-yl]oxy-2-hydroxy-cyclohexoxy]-2-(hydroxymethyl)tetrahydropyran-3-ol
IUPAC Name: (2R,3S,4R,5R,6S)-4,5-diamino-6-[(1S,2S,3R,4S,6R)-4,6-diamino-3-[(2R,3R,6S)-3-amino-6-(aminomethyl)oxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-2-(hydroxymethyl)oxan-3-ol
SYSTEMATIC NAME: (2R,3S,4R,5R,6S)-6-[(1S,2S,3R,4S,6R)-3-[(2R,3R,6S)-6-(aminomethyl)-3-azanyl-oxan-2-yl]oxy-4,6-bis(azanyl)-2-oxidanyl-cyclohexyl]oxy-4,5-bis(azanyl)-2-(hydroxymethyl)oxan-3-ol
MOLECULAR FORMULA: C18H38N6O7
MOLECULAR WEIGHT: 450.53032
SMILES: C1C[C@H]([C@H](O[C@@H]1CN)O[C@@H]2[C@H](C[C@H]([C@@H]([C@H]2O)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)N)N)N)N)N
Structure:

CAS RN: 147920-23-8
CAS Name: (2S)-4-amino-N-[(1R,2R,4S,5S)-5-amino-4-[[(2R,3R,6S)-3-amino-6-(aminomethyl)-2-oxanyl]oxy]-2-[[(2S,3R,4R,5S,6R)-3,4-diamino-5-hydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]cyclohexyl]-2-hydroxybutanamide
OPENEYE Name: (2S)-4-amino-N-[(1R,2R,4S,5S)-5-amino-4-[(2R,3R,6S)-3-amino-6-(aminomethyl)tetrahydropyran-2-yl]oxy-2-[(2S,3R,4R,5S,6R)-3,4-diamino-5-hydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-cyclohexyl]-2-hydroxy-butanamide
IUPAC Name: (2S)-4-amino-N-[(1R,2R,4S,5S)-5-amino-4-[(2R,3R,6S)-3-amino-6-(aminomethyl)oxan-2-yl]oxy-2-[(2S,3R,4R,5S,6R)-3,4-diamino-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohexyl]-2-hydroxybutanamide
SYSTEMATIC NAME: (2S)-N-[(1R,2R,4S,5S)-4-[(2R,3R,6S)-6-(aminomethyl)-3-azanyl-oxan-2-yl]oxy-5-azanyl-2-[(2S,3R,4R,5S,6R)-3,4-bis(azanyl)-6-(hydroxymethyl)-5-oxidanyl-oxan-2-yl]oxy-cyclohexyl]-4-azanyl-2-oxidanyl-butanamide
MOLECULAR FORMULA: C22H45N7O8
MOLECULAR WEIGHT: 535.6348
SMILES: C1C[C@H]([C@H](O[C@@H]1CN)O[C@H]2C[C@H]([C@@H](C[C@@H]2N)NC(=O)[C@H](CCN)O)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)N)N)N
Structure:

CAS RN: 147879-86-5
CAS Name: 2-[[2-[(acetylthio)methyl]-1-oxo-3-phenylpropyl]amino]acetic acid 1,3-bis[[1-adamantyl(oxo)methyl]amino]propan-2-yl ester
OPENEYE Name: [2-(adamantane-1-carbonylamino)-1-[(adamantane-1-carbonylamino)methyl]ethyl] 2-[[2-(acetylsulfanylmethyl)-3-phenyl-propanoyl]amino]acetate
IUPAC Name: 1,3-bis(adamantane-1-carbonylamino)propan-2-yl 2-[[2-(acetylsulfanylmethyl)-3-phenylpropanoyl]amino]acetate
SYSTEMATIC NAME: 1,3-bis(1-adamantylcarbonylamino)propan-2-yl 2-[[2-(ethanoylsulfanylmethyl)-3-phenyl-propanoyl]amino]ethanoate
MOLECULAR FORMULA: C39H53N3O6S
MOLECULAR WEIGHT: 691.91962
SMILES: CC(=O)SCC(CC1=CC=CC=C1)C(=O)NCC(=O)OC(CNC(=O)C23CC4CC(C2)CC(C4)C3)CNC(=O)C56CC7CC(C5)CC(C7)C6
Structure:

CAS RN: 147879-85-4
CAS Name: 2-[[2-[(acetylthio)methyl]-1-oxo-3-phenylpropyl]amino]acetic acid 1,3-bis[(1-oxo-3-phenylpropyl)amino]propan-2-yl ester
OPENEYE Name: [2-(3-phenylpropanoylamino)-1-[(3-phenylpropanoylamino)methyl]ethyl] 2-[[2-(acetylsulfanylmethyl)-3-phenyl-propanoyl]amino]acetate
IUPAC Name: 1,3-bis(3-phenylpropanoylamino)propan-2-yl 2-[[2-(acetylsulfanylmethyl)-3-phenylpropanoyl]amino]acetate
SYSTEMATIC NAME: 1,3-bis(3-phenylpropanoylamino)propan-2-yl 2-[[2-(ethanoylsulfanylmethyl)-3-phenyl-propanoyl]amino]ethanoate
MOLECULAR FORMULA: C35H41N3O6S
MOLECULAR WEIGHT: 631.78154
SMILES: CC(=O)SCC(CC1=CC=CC=C1)C(=O)NCC(=O)OC(CNC(=O)CCC2=CC=CC=C2)CNC(=O)CCC3=CC=CC=C3
Structure:

CAS RN: 147879-84-3
CAS Name: 2-[[2-[(acetylthio)methyl]-1-oxo-3-phenylpropyl]amino]acetic acid 1,3-bis[(3-cyclohexyl-1-oxopropyl)amino]propan-2-yl ester
OPENEYE Name: [2-(3-cyclohexylpropanoylamino)-1-[(3-cyclohexylpropanoylamino)methyl]ethyl] 2-[[2-(acetylsulfanylmethyl)-3-phenyl-propanoyl]amino]acetate
IUPAC Name: 1,3-bis(3-cyclohexylpropanoylamino)propan-2-yl 2-[[2-(acetylsulfanylmethyl)-3-phenylpropanoyl]amino]acetate
SYSTEMATIC NAME: 1,3-bis(3-cyclohexylpropanoylamino)propan-2-yl 2-[[2-(ethanoylsulfanylmethyl)-3-phenyl-propanoyl]amino]ethanoate
MOLECULAR FORMULA: C35H53N3O6S
MOLECULAR WEIGHT: 643.87682
SMILES: CC(=O)SCC(CC1=CC=CC=C1)C(=O)NCC(=O)OC(CNC(=O)CCC2CCCCC2)CNC(=O)CCC3CCCCC3
Structure:

CAS RN: 147879-83-2
CAS Name: 2-[[2-[(acetylthio)methyl]-1-oxo-3-phenylpropyl]amino]acetic acid 1,3-bis(1-oxodecylamino)propan-2-yl ester
OPENEYE Name: [2-(decanoylamino)-1-[(decanoylamino)methyl]ethyl] 2-[[2-(acetylsulfanylmethyl)-3-phenyl-propanoyl]amino]acetate
IUPAC Name: 1,3-bis(decanoylamino)propan-2-yl 2-[[2-(acetylsulfanylmethyl)-3-phenylpropanoyl]amino]acetate
SYSTEMATIC NAME: 1,3-bis(decanoylamino)propan-2-yl 2-[[2-(ethanoylsulfanylmethyl)-3-phenyl-propanoyl]amino]ethanoate
MOLECULAR FORMULA: C37H61N3O6S
MOLECULAR WEIGHT: 675.96174
SMILES: CCCCCCCCCC(=O)NCC(CNC(=O)CCCCCCCCC)OC(=O)CNC(=O)C(CC1=CC=CC=C1)CSC(=O)C
Structure:

CAS RN: 147879-82-1
CAS Name: 2-[[2-[(acetylthio)methyl]-1-oxo-3-phenylpropyl]amino]acetic acid 1,3-bis(1-oxohexadecylamino)propan-2-yl ester
OPENEYE Name: [2-(hexadecanoylamino)-1-[(hexadecanoylamino)methyl]ethyl] 2-[[2-(acetylsulfanylmethyl)-3-phenyl-propanoyl]amino]acetate
IUPAC Name: 1,3-bis(hexadecanoylamino)propan-2-yl 2-[[2-(acetylsulfanylmethyl)-3-phenylpropanoyl]amino]acetate
SYSTEMATIC NAME: 1,3-bis(hexadecanoylamino)propan-2-yl 2-[[2-(ethanoylsulfanylmethyl)-3-phenyl-propanoyl]amino]ethanoate
MOLECULAR FORMULA: C49H85N3O6S
MOLECULAR WEIGHT: 844.2807
SMILES: CCCCCCCCCCCCCCCC(=O)NCC(CNC(=O)CCCCCCCCCCCCCCC)OC(=O)CNC(=O)C(CC1=CC=CC=C1)CSC(=O)C
Structure:

CAS RN: 147821-54-3
CAS Name: 2-(2-methoxyphenyl)-1-methyl-5-oxo-2,3-dihydroimidazo[1,2-a]pyrimidine-6-carboxylic acid ethyl ester
OPENEYE Name: ethyl 2-(2-methoxyphenyl)-1-methyl-5-oxo-2,3-dihydroimidazo[1,2-a]pyrimidine-6-carboxylate
IUPAC Name: ethyl 2-(2-methoxyphenyl)-1-methyl-5-oxo-2,3-dihydroimidazo[1,2-a]pyrimidine-6-carboxylate
SYSTEMATIC NAME: ethyl 2-(2-methoxyphenyl)-1-methyl-5-oxidanylidene-2,3-dihydroimidazo[1,2-a]pyrimidine-6-carboxylate
MOLECULAR FORMULA: C17H19N3O4
MOLECULAR WEIGHT: 329.35046
SMILES: CCOC(=O)C1=CN=C2N(C(CN2C1=O)C3=CC=CC=C3OC)C
Structure:

CAS RN: 147821-53-2
CAS Name: 1-(3-chlorophenyl)-5-oxo-2,3-dihydroimidazo[1,2-a]pyrimidine-6-carboxylic acid ethyl ester
OPENEYE Name: ethyl 1-(3-chlorophenyl)-5-oxo-2,3-dihydroimidazo[1,2-a]pyrimidine-6-carboxylate
IUPAC Name: ethyl 1-(3-chlorophenyl)-5-oxo-2,3-dihydroimidazo[1,2-a]pyrimidine-6-carboxylate
SYSTEMATIC NAME: ethyl 1-(3-chlorophenyl)-5-oxidanylidene-2,3-dihydroimidazo[1,2-a]pyrimidine-6-carboxylate
MOLECULAR FORMULA: C15H14ClN3O3
MOLECULAR WEIGHT: 319.74296
SMILES: CCOC(=O)C1=CN=C2N(CCN2C1=O)C3=CC(=CC=C3)Cl
Structure:

CAS RN: 147821-52-1
CAS Name: 1-(4-methylphenyl)-5-oxo-2,3-dihydroimidazo[1,2-a]pyrimidine-6-carboxylic acid ethyl ester
OPENEYE Name: ethyl 5-oxo-1-(p-tolyl)-2,3-dihydroimidazo[1,2-a]pyrimidine-6-carboxylate
IUPAC Name: ethyl 1-(4-methylphenyl)-5-oxo-2,3-dihydroimidazo[1,2-a]pyrimidine-6-carboxylate
SYSTEMATIC NAME: ethyl 1-(4-methylphenyl)-5-oxidanylidene-2,3-dihydroimidazo[1,2-a]pyrimidine-6-carboxylate
MOLECULAR FORMULA: C16H17N3O3
MOLECULAR WEIGHT: 299.32448
SMILES: CCOC(=O)C1=CN=C2N(CCN2C1=O)C3=CC=C(C=C3)C
Structure:

CAS RN: 147529-98-4
CAS Name: acetic acid [(2S)-3-[2-[2-[[(2S)-3-acetyloxy-2-amino-1-oxopropyl]amino]ethyldisulfanyl]ethylamino]-2-amino-3-oxopropyl] ester; 2,2,2-trifluoroacetic acid
OPENEYE Name: [(2S)-3-[2-[2-[[(2S)-3-acetoxy-2-amino-propanoyl]amino]ethyldisulfanyl]ethylamino]-2-amino-3-oxo-propyl] acetate; 2,2,2-trifluoroacetic acid
IUPAC Name: [(2S)-3-[2-[2-[[(2S)-3-acetyloxy-2-aminopropanoyl]amino]ethyldisulfanyl]ethylamino]-2-amino-3-oxopropyl] acetate; 2,2,2-trifluoroacetic acid
SYSTEMATIC NAME: [(2S)-3-[2-[2-[[(2S)-3-acetyloxy-2-azanyl-propanoyl]amino]ethyldisulfanyl]ethylamino]-2-azanyl-3-oxidanylidene-propyl] ethanoate; 2,2,2-tris(fluoranyl)ethanoic acid
MOLECULAR FORMULA: C18H28F6N4O10S2
MOLECULAR WEIGHT: 638.556139
SMILES: CC(=O)OC[C@@H](C(=O)NCCSSCCNC(=O)[C@H](COC(=O)C)N)N.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O
Structure:

CAS RN: 147529-95-1
CAS Name: acetic acid [(2S)-3-[2-(acetylthio)ethylamino]-2-amino-3-oxopropyl] ester; 2,2,2-trifluoroacetic acid
OPENEYE Name: [(2S)-3-(2-acetylsulfanylethylamino)-2-amino-3-oxo-propyl] acetate; 2,2,2-trifluoroacetic acid
IUPAC Name: [(2S)-3-(2-acetylsulfanylethylamino)-2-amino-3-oxopropyl] acetate; 2,2,2-trifluoroacetic acid
SYSTEMATIC NAME: [(2S)-2-azanyl-3-(2-ethanoylsulfanylethylamino)-3-oxidanylidene-propyl] ethanoate; 2,2,2-tris(fluoranyl)ethanoic acid
MOLECULAR FORMULA: C11H17F3N2O6S
MOLECULAR WEIGHT: 362.32269
SMILES: CC(=O)OC[C@@H](C(=O)NCCSC(=O)C)N.C(=O)(C(F)(F)F)O
Structure:

CAS RN: 147529-92-8
CAS Name: (4R)-3-[2-[2-[(4R)-4-carbamoyl-3-thiazolidinyl]ethyldisulfanyl]ethyl]-4-thiazolidinecarboxamide; 2,2,2-trifluoroacetic acid
OPENEYE Name: (4R)-3-[2-[2-[(4R)-4-carbamoylthiazolidin-3-yl]ethyldisulfanyl]ethyl]thiazolidine-4-carboxamide; 2,2,2-trifluoroacetic acid
IUPAC Name: (4R)-3-[2-[2-[(4R)-4-carbamoyl-1,3-thiazolidin-3-yl]ethyldisulfanyl]ethyl]-1,3-thiazolidine-4-carboxamide; 2,2,2-trifluoroacetic acid
SYSTEMATIC NAME: (4R)-3-[2-[2-[(4R)-4-aminocarbonyl-1,3-thiazolidin-3-yl]ethyldisulfanyl]ethyl]-1,3-thiazolidine-4-carboxamide; 2,2,2-tris(fluoranyl)ethanoic acid
MOLECULAR FORMULA: C16H24F6N4O6S4
MOLECULAR WEIGHT: 610.635379
SMILES: C1[C@H](N(CS1)CCSSCCN2CSC[C@H]2C(=O)N)C(=O)N.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O
Structure:

CAS RN: 147529-90-6
CAS Name: (2S)-1-[2-[2-[(2S)-2-carbamoyl-1-pyrrolidinyl]ethyldisulfanyl]ethyl]-2-pyrrolidinecarboxamide; 2,2,2-trifluoroacetic acid
OPENEYE Name: (2S)-1-[2-[2-[(2S)-2-carbamoylpyrrolidin-1-yl]ethyldisulfanyl]ethyl]pyrrolidine-2-carboxamide; 2,2,2-trifluoroacetic acid
IUPAC Name: (2S)-1-[2-[2-[(2S)-2-carbamoylpyrrolidin-1-yl]ethyldisulfanyl]ethyl]pyrrolidine-2-carboxamide; 2,2,2-trifluoroacetic acid
SYSTEMATIC NAME: (2S)-1-[2-[2-[(2S)-2-aminocarbonylpyrrolidin-1-yl]ethyldisulfanyl]ethyl]pyrrolidine-2-carboxamide; 2,2,2-tris(fluoranyl)ethanoic acid
MOLECULAR FORMULA: C18H28F6N4O6S2
MOLECULAR WEIGHT: 574.558539
SMILES: C1C[C@H](N(C1)CCSSCCN2CCC[C@H]2C(=O)N)C(=O)N.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O
Structure:

CAS RN: 147529-88-2
CAS Name: (2S)-2-amino-N-[2-[2-[[(2S)-2-amino-3-hydroxy-1-oxopropyl]amino]ethyldisulfanyl]ethyl]-3-hydroxypropanamide; 2,2,2-trifluoroacetic acid
OPENEYE Name: (2S)-2-amino-N-[2-[2-[[(2S)-2-amino-3-hydroxy-propanoyl]amino]ethyldisulfanyl]ethyl]-3-hydroxy-propanamide; 2,2,2-trifluoroacetic acid
IUPAC Name: (2S)-2-amino-N-[2-[2-[[(2S)-2-amino-3-hydroxypropanoyl]amino]ethyldisulfanyl]ethyl]-3-hydroxypropanamide; 2,2,2-trifluoroacetic acid
SYSTEMATIC NAME: (2S)-2-azanyl-N-[2-[2-[[(2S)-2-azanyl-3-oxidanyl-propanoyl]amino]ethyldisulfanyl]ethyl]-3-oxidanyl-propanamide; 2,2,2-tris(fluoranyl)ethanoic acid
MOLECULAR FORMULA: C14H24F6N4O8S2
MOLECULAR WEIGHT: 554.482779
SMILES: C(CSSCCNC(=O)[C@H](CO)N)NC(=O)[C@H](CO)N.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O
Structure:

CAS RN: 147529-83-7
CAS Name: ethanethioic acid S-[2-[[oxo-[(4R)-4-thiazolidinyl]methyl]amino]ethyl] ester; 2,2,2-trifluoroacetic acid
OPENEYE Name: S-[2-[[(4R)-thiazolidine-4-carbonyl]amino]ethyl] ethanethioate; 2,2,2-trifluoroacetic acid
IUPAC Name: S-[2-[[(4R)-1,3-thiazolidine-4-carbonyl]amino]ethyl] ethanethioate; 2,2,2-trifluoroacetic acid
SYSTEMATIC NAME: S-[2-[[(4R)-1,3-thiazolidin-4-yl]carbonylamino]ethyl] ethanethioate; 2,2,2-tris(fluoranyl)ethanoic acid
MOLECULAR FORMULA: C10H15F3N2O4S2
MOLECULAR WEIGHT: 348.36231
SMILES: CC(=O)SCCNC(=O)[C@@H]1CSCN1.C(=O)(C(F)(F)F)O
Structure:

CAS RN: 147529-81-5
CAS Name: ethanethioic acid S-[2-[[oxo-[(2S)-2-pyrrolidinyl]methyl]amino]ethyl] ester; 2,2,2-trifluoroacetic acid
OPENEYE Name: S-[2-[[(2S)-pyrrolidine-2-carbonyl]amino]ethyl] ethanethioate; 2,2,2-trifluoroacetic acid
IUPAC Name: S-[2-[[(2S)-pyrrolidine-2-carbonyl]amino]ethyl] ethanethioate; 2,2,2-trifluoroacetic acid
SYSTEMATIC NAME: S-[2-[[(2S)-pyrrolidin-2-yl]carbonylamino]ethyl] ethanethioate; 2,2,2-tris(fluoranyl)ethanoic acid
MOLECULAR FORMULA: C11H17F3N2O4S
MOLECULAR WEIGHT: 330.32389
SMILES: CC(=O)SCCNC(=O)[C@@H]1CCCN1.C(=O)(C(F)(F)F)O
Structure:

CAS RN: 147529-79-1
CAS Name: ethanethioic acid S-[2-[[(2S)-2-amino-1-oxo-3-phenylpropyl]amino]ethyl] ester; 2,2,2-trifluoroacetic acid
OPENEYE Name: S-[2-[[(2S)-2-amino-3-phenyl-propanoyl]amino]ethyl] ethanethioate; 2,2,2-trifluoroacetic acid
IUPAC Name: S-[2-[[(2S)-2-amino-3-phenylpropanoyl]amino]ethyl] ethanethioate; 2,2,2-trifluoroacetic acid
SYSTEMATIC NAME: S-[2-[[(2S)-2-azanyl-3-phenyl-propanoyl]amino]ethyl] ethanethioate; 2,2,2-tris(fluoranyl)ethanoic acid
MOLECULAR FORMULA: C15H19F3N2O4S
MOLECULAR WEIGHT: 380.38257
SMILES: CC(=O)SCCNC(=O)[C@H](CC1=CC=CC=C1)N.C(=O)(C(F)(F)F)O
Structure:

CAS RN: 147529-77-9
CAS Name: ethanethioic acid S-[2-[[(2S)-2-amino-3-hydroxy-1-oxopropyl]amino]ethyl] ester; 2,2,2-trifluoroacetic acid
OPENEYE Name: S-[2-[[(2S)-2-amino-3-hydroxy-propanoyl]amino]ethyl] ethanethioate; 2,2,2-trifluoroacetic acid
IUPAC Name: S-[2-[[(2S)-2-amino-3-hydroxypropanoyl]amino]ethyl] ethanethioate; 2,2,2-trifluoroacetic acid
SYSTEMATIC NAME: S-[2-[[(2S)-2-azanyl-3-oxidanyl-propanoyl]amino]ethyl] ethanethioate; 2,2,2-tris(fluoranyl)ethanoic acid
MOLECULAR FORMULA: C9H15F3N2O5S
MOLECULAR WEIGHT: 320.28601
SMILES: CC(=O)SCCNC(=O)[C@H](CO)N.C(=O)(C(F)(F)F)O
Structure:

CAS RN: 147528-38-9
CAS Name: 3-methyl-4-oxo-2-phenyl-1-benzopyran-8-carboxylic acid [(1R,2R)-2-(1-piperidinyl)cyclohexyl] ester hydrochloride
OPENEYE Name: [(1R,2R)-2-(1-piperidyl)cyclohexyl] 3-methyl-4-oxo-2-phenyl-chromene-8-carboxylate hydrochloride
IUPAC Name: [(1R,2R)-2-piperidin-1-ylcyclohexyl] 3-methyl-4-oxo-2-phenylchromene-8-carboxylate hydrochloride
SYSTEMATIC NAME: [(1R,2R)-2-piperidin-1-ylcyclohexyl] 3-methyl-4-oxidanylidene-2-phenyl-chromene-8-carboxylate hydrochloride
MOLECULAR FORMULA: C28H32ClNO4
MOLECULAR WEIGHT: 482.01098
SMILES: CC1=C(OC2=C(C1=O)C=CC=C2C(=O)O[C@@H]3CCCC[C@H]3N4CCCCC4)C5=CC=CC=C5.Cl
Structure:

CAS RN: 147528-34-5
CAS Name: 3-methyl-4-oxo-2-phenyl-1-benzopyran-8-carboxylic acid [1-phenyl-2-(1-piperidinyl)ethyl] ester hydrochloride
OPENEYE Name: [1-phenyl-2-(1-piperidyl)ethyl] 3-methyl-4-oxo-2-phenyl-chromene-8-carboxylate hydrochloride
IUPAC Name: (1-phenyl-2-piperidin-1-ylethyl) 3-methyl-4-oxo-2-phenylchromene-8-carboxylate hydrochloride
SYSTEMATIC NAME: (1-phenyl-2-piperidin-1-yl-ethyl) 3-methyl-4-oxidanylidene-2-phenyl-chromene-8-carboxylate hydrochloride
MOLECULAR FORMULA: C30H30ClNO4
MOLECULAR WEIGHT: 504.0165
SMILES: CC1=C(OC2=C(C1=O)C=CC=C2C(=O)OC(CN3CCCCC3)C4=CC=CC=C4)C5=CC=CC=C5.Cl
Structure:

CAS RN: 147528-33-4
CAS Name: 3-methyl-4-oxo-2-phenyl-1-benzopyran-8-carboxylic acid [2-methyl-1-(2-methyl-1-piperidinyl)propan-2-yl] ester hydrochloride
OPENEYE Name: [1,1-dimethyl-2-(2-methyl-1-piperidyl)ethyl] 3-methyl-4-oxo-2-phenyl-chromene-8-carboxylate hydrochloride
IUPAC Name: [2-methyl-1-(2-methylpiperidin-1-yl)propan-2-yl] 3-methyl-4-oxo-2-phenylchromene-8-carboxylate hydrochloride
SYSTEMATIC NAME: [2-methyl-1-(2-methylpiperidin-1-yl)propan-2-yl] 3-methyl-4-oxidanylidene-2-phenyl-chromene-8-carboxylate hydrochloride
MOLECULAR FORMULA: C27H32ClNO4
MOLECULAR WEIGHT: 470.00028
SMILES: CC1CCCCN1CC(C)(C)OC(=O)C2=CC=CC3=C2OC(=C(C3=O)C)C4=CC=CC=C4.Cl
Structure:

CAS RN: 147419-95-2
CAS Name: 2-(dimethylamino)-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide
OPENEYE Name: 2-(dimethylamino)-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide
IUPAC Name: 2-(dimethylamino)-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide
SYSTEMATIC NAME: 2-(dimethylamino)-N-(5-methyl-1,3,4-oxadiazol-2-yl)ethanamide
MOLECULAR FORMULA: C7H12N4O2
MOLECULAR WEIGHT: 184.19578
SMILES: CC1=NN=C(O1)NC(=O)CN(C)C
Structure:

CAS RN: 147396-48-3
CAS Name: 2-(dipropylamino)-N-(5-propyl-1,3,4-oxadiazol-2-yl)acetamide
OPENEYE Name: 2-(dipropylamino)-N-(5-propyl-1,3,4-oxadiazol-2-yl)acetamide
IUPAC Name: 2-(dipropylamino)-N-(5-propyl-1,3,4-oxadiazol-2-yl)acetamide
SYSTEMATIC NAME: 2-(dipropylamino)-N-(5-propyl-1,3,4-oxadiazol-2-yl)ethanamide
MOLECULAR FORMULA: C13H24N4O2
MOLECULAR WEIGHT: 268.35526
SMILES: CCCC1=NN=C(O1)NC(=O)CN(CCC)CCC
Structure:

CAS RN: 147396-47-2
CAS Name: 2-(dipropylamino)-N-(5-ethyl-1,3,4-oxadiazol-2-yl)acetamide
OPENEYE Name: 2-(dipropylamino)-N-(5-ethyl-1,3,4-oxadiazol-2-yl)acetamide
IUPAC Name: 2-(dipropylamino)-N-(5-ethyl-1,3,4-oxadiazol-2-yl)acetamide
SYSTEMATIC NAME: 2-(dipropylamino)-N-(5-ethyl-1,3,4-oxadiazol-2-yl)ethanamide
MOLECULAR FORMULA: C12H22N4O2
MOLECULAR WEIGHT: 254.32868
SMILES: CCCN(CCC)CC(=O)NC1=NN=C(O1)CC
Structure:

CAS RN: 147396-46-1
CAS Name: 2-(dipropylamino)-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide
OPENEYE Name: 2-(dipropylamino)-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide
IUPAC Name: 2-(dipropylamino)-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide
SYSTEMATIC NAME: 2-(dipropylamino)-N-(5-methyl-1,3,4-oxadiazol-2-yl)ethanamide
MOLECULAR FORMULA: C11H20N4O2
MOLECULAR WEIGHT: 240.3021
SMILES: CCCN(CCC)CC(=O)NC1=NN=C(O1)C
Structure:

CAS RN: 147396-45-0
CAS Name: 2-(diethylamino)-N-(5-propyl-1,3,4-oxadiazol-2-yl)acetamide
OPENEYE Name: 2-(diethylamino)-N-(5-propyl-1,3,4-oxadiazol-2-yl)acetamide
IUPAC Name: 2-(diethylamino)-N-(5-propyl-1,3,4-oxadiazol-2-yl)acetamide
SYSTEMATIC NAME: 2-(diethylamino)-N-(5-propyl-1,3,4-oxadiazol-2-yl)ethanamide
MOLECULAR FORMULA: C11H20N4O2
MOLECULAR WEIGHT: 240.3021
SMILES: CCCC1=NN=C(O1)NC(=O)CN(CC)CC
Structure:

CAS RN: 147396-44-9
CAS Name: 2-(diethylamino)-N-(5-ethyl-1,3,4-oxadiazol-2-yl)acetamide
OPENEYE Name: 2-(diethylamino)-N-(5-ethyl-1,3,4-oxadiazol-2-yl)acetamide
IUPAC Name: 2-(diethylamino)-N-(5-ethyl-1,3,4-oxadiazol-2-yl)acetamide
SYSTEMATIC NAME: 2-(diethylamino)-N-(5-ethyl-1,3,4-oxadiazol-2-yl)ethanamide
MOLECULAR FORMULA: C10H18N4O2
MOLECULAR WEIGHT: 226.27552
SMILES: CCC1=NN=C(O1)NC(=O)CN(CC)CC
Structure:

CAS RN: 147396-43-8
CAS Name: 2-(diethylamino)-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide
OPENEYE Name: 2-(diethylamino)-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide
IUPAC Name: 2-(diethylamino)-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide
SYSTEMATIC NAME: 2-(diethylamino)-N-(5-methyl-1,3,4-oxadiazol-2-yl)ethanamide
MOLECULAR FORMULA: C9H16N4O2
MOLECULAR WEIGHT: 212.24894
SMILES: CCN(CC)CC(=O)NC1=NN=C(O1)C
Structure:

CAS RN: 147396-42-7
CAS Name: 2-(dimethylamino)-N-(5-propyl-1,3,4-oxadiazol-2-yl)acetamide
OPENEYE Name: 2-(dimethylamino)-N-(5-propyl-1,3,4-oxadiazol-2-yl)acetamide
IUPAC Name: 2-(dimethylamino)-N-(5-propyl-1,3,4-oxadiazol-2-yl)acetamide
SYSTEMATIC NAME: 2-(dimethylamino)-N-(5-propyl-1,3,4-oxadiazol-2-yl)ethanamide
MOLECULAR FORMULA: C9H16N4O2
MOLECULAR WEIGHT: 212.24894
SMILES: CCCC1=NN=C(O1)NC(=O)CN(C)C
Structure:

CAS RN: 147396-41-6
CAS Name: 2-(dimethylamino)-N-(5-ethyl-1,3,4-oxadiazol-2-yl)acetamide
OPENEYE Name: 2-(dimethylamino)-N-(5-ethyl-1,3,4-oxadiazol-2-yl)acetamide
IUPAC Name: 2-(dimethylamino)-N-(5-ethyl-1,3,4-oxadiazol-2-yl)acetamide
SYSTEMATIC NAME: 2-(dimethylamino)-N-(5-ethyl-1,3,4-oxadiazol-2-yl)ethanamide
MOLECULAR FORMULA: C8H14N4O2
MOLECULAR WEIGHT: 198.22236
SMILES: CCC1=NN=C(O1)NC(=O)CN(C)C
Structure:

CAS RN: 147394-60-3
CAS Name: (4-fluorophenyl)-(2-methyl-2,3-dihydrobenzofuran-5-yl)methanone
OPENEYE Name: (4-fluorophenyl)-(2-methyl-2,3-dihydrobenzofuran-5-yl)methanone
IUPAC Name: (4-fluorophenyl)-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanone
SYSTEMATIC NAME: (4-fluorophenyl)-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanone
MOLECULAR FORMULA: C16H13FO2
MOLECULAR WEIGHT: 256.271623
SMILES: CC1CC2=C(O1)C=CC(=C2)C(=O)C3=CC=C(C=C3)F
Structure: