CAS RN: 64463-45-2
CAS Name: 5-amino-6-(7-amino-6-methoxy-5,8-dioxo-2-quinolinyl)-4-bromo-3-methyl-2-pyridinecarboxylic acid
OPENEYE Name: 5-amino-6-(7-amino-6-methoxy-5,8-dioxo-2-quinolyl)-4-bromo-3-methyl-pyridine-2-carboxylic acid
IUPAC Name: 5-amino-6-(7-amino-6-methoxy-5,8-dioxoquinolin-2-yl)-4-bromo-3-methylpyridine-2-carboxylic acid
SYSTEMATIC NAME: 5-azanyl-6-[7-azanyl-6-methoxy-5,8-bis(oxidanylidene)quinolin-2-yl]-4-bromanyl-3-methyl-pyridine-2-carboxylic acid
MOLECULAR FORMULA: C17H13BrN4O5
MOLECULAR WEIGHT: 433.21292
SMILES: CC1=C(C(=C(N=C1C(=O)O)C2=NC3=C(C=C2)C(=O)C(=C(C3=O)N)OC)N)Br
Structure:
CAS RN: 57179-31-4
CAS Name: 7-amino-6-methoxy-2-(2-pyridinyl)quinoline-5,8-dione
OPENEYE Name: 7-amino-6-methoxy-2-(2-pyridyl)quinoline-5,8-dione
IUPAC Name: 7-amino-6-methoxy-2-pyridin-2-ylquinoline-5,8-dione
SYSTEMATIC NAME: 7-azanyl-6-methoxy-2-pyridin-2-yl-quinoline-5,8-dione
MOLECULAR FORMULA: C15H11N3O3
MOLECULAR WEIGHT: 281.26614
SMILES: COC1=C(C(=O)C2=C(C1=O)C=CC(=N2)C3=CC=CC=N3)N
Structure:
CAS RN: 76881-19-1
CAS Name: trifluoromethanesulfonic acid (5,5-dimethyl-3-oxo-1-cyclohexenyl) ester
OPENEYE Name: (5,5-dimethyl-3-oxo-cyclohexen-1-yl) trifluoromethanesulfonate
IUPAC Name: (5,5-dimethyl-3-oxocyclohexen-1-yl) trifluoromethanesulfonate
SYSTEMATIC NAME: (5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl) tris(fluoranyl)methanesulfonate
MOLECULAR FORMULA: C9H11F3O4S
MOLECULAR WEIGHT: 272.24145
SMILES: CC1(CC(=CC(=O)C1)OS(=O)(=O)C(F)(F)F)C
Structure:
CAS RN: 53751-62-5
CAS Name: 4-(methylthio)-2-[[[[4-(methylthio)-1-(4-nitrophenoxy)-1-oxobutan-2-yl]amino]-oxomethyl]amino]butanoic acid (4-nitrophenyl) ester
OPENEYE Name: (4-nitrophenyl) 4-methylsulfanyl-2-[[3-methylsulfanyl-1-(4-nitrophenoxy)carbonyl-propyl]carbamoylamino]butanoate
IUPAC Name: (4-nitrophenyl) 4-methylsulfanyl-2-[[4-methylsulfanyl-1-(4-nitrophenoxy)-1-oxobutan-2-yl]carbamoylamino]butanoate
SYSTEMATIC NAME: (4-nitrophenyl) 4-methylsulfanyl-2-[[4-methylsulfanyl-1-(4-nitrophenoxy)-1-oxidanylidene-butan-2-yl]carbamoylamino]butanoate
MOLECULAR FORMULA: C23H26N4O9S2
MOLECULAR WEIGHT: 566.60394
SMILES: CSCCC(C(=O)OC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)NC(CCSC)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-]
Structure:
CAS RN: 5223-34-7
CAS Name: 2-chloro-5,8-dihydroxy-6,7-dimethylnaphthalene-1,4-dione
OPENEYE Name: 2-chloro-5,8-dihydroxy-6,7-dimethyl-naphthalene-1,4-dione
IUPAC Name: 2-chloro-5,8-dihydroxy-6,7-dimethylnaphthalene-1,4-dione
SYSTEMATIC NAME: 2-chloranyl-6,7-dimethyl-5,8-bis(oxidanyl)naphthalene-1,4-dione
MOLECULAR FORMULA: C12H9ClO4
MOLECULAR WEIGHT: 252.65046
SMILES: CC1=C(C2=C(C(=C1C)O)C(=O)C(=CC2=O)Cl)O
Structure:
CAS RN: 83578-17-0
CAS Name: 5-anilino-3-butyl-2H-indazole-4,7-dione
OPENEYE Name: 5-anilino-3-butyl-2H-indazole-4,7-dione
IUPAC Name: 5-anilino-3-butyl-2H-indazole-4,7-dione
SYSTEMATIC NAME: 3-butyl-5-phenylazanyl-2H-indazole-4,7-dione
MOLECULAR FORMULA: C17H17N3O2
MOLECULAR WEIGHT: 295.33578
SMILES: CCCCC1=C2C(=NN1)C(=O)C=C(C2=O)NC3=CC=CC=C3
Structure:
CAS RN: 78205-48-8
CAS Name: 1-[[8-amino-9-[(4-hydroxy-2-methoxycarbonyl-1-pyrrolidinyl)-oxomethyl]-4,6-dimethyl-7-oxo-1-phenoxazinyl]-oxomethyl]-4-hydroxy-2-pyrrolidinecarboxylic acid methyl ester
OPENEYE Name: methyl 1-[8-amino-9-(4-hydroxy-2-methoxycarbonyl-pyrrolidine-1-carbonyl)-4,6-dimethyl-7-oxo-phenoxazine-1-carbonyl]-4-hydroxy-pyrrolidine-2-carboxylate
IUPAC Name: methyl 1-[8-amino-9-(4-hydroxy-2-methoxycarbonylpyrrolidine-1-carbonyl)-4,6-dimethyl-7-oxophenoxazine-1-carbonyl]-4-hydroxypyrrolidine-2-carboxylate
SYSTEMATIC NAME: methyl 1-[8-azanyl-9-(2-methoxycarbonyl-4-oxidanyl-pyrrolidin-1-yl)carbonyl-4,6-dimethyl-7-oxidanylidene-phenoxazin-1-yl]carbonyl-4-oxidanyl-pyrrolidine-2-carboxylate
MOLECULAR FORMULA: C28H30N4O10
MOLECULAR WEIGHT: 582.5586
SMILES: CC1=C2C(=C(C=C1)C(=O)N3CC(CC3C(=O)OC)O)N=C4C(=C(C(=O)C(=C4O2)C)N)C(=O)N5CC(CC5C(=O)OC)O
Structure:
CAS RN: 78205-47-7
CAS Name: 1-[[8-amino-9-[(2-ethoxycarbonyl-1-pyrrolidinyl)-oxomethyl]-4,6-dimethyl-7-oxo-1-phenoxazinyl]-oxomethyl]-2-pyrrolidinecarboxylic acid ethyl ester
OPENEYE Name: ethyl 1-[8-amino-9-(2-ethoxycarbonylpyrrolidine-1-carbonyl)-4,6-dimethyl-7-oxo-phenoxazine-1-carbonyl]pyrrolidine-2-carboxylate
IUPAC Name: ethyl 1-[8-amino-9-(2-ethoxycarbonylpyrrolidine-1-carbonyl)-4,6-dimethyl-7-oxophenoxazine-1-carbonyl]pyrrolidine-2-carboxylate
SYSTEMATIC NAME: ethyl 1-[8-azanyl-9-(2-ethoxycarbonylpyrrolidin-1-yl)carbonyl-4,6-dimethyl-7-oxidanylidene-phenoxazin-1-yl]carbonylpyrrolidine-2-carboxylate
MOLECULAR FORMULA: C30H34N4O8
MOLECULAR WEIGHT: 578.61296
SMILES: CCOC(=O)C1CCCN1C(=O)C2=C3C(=C(C=C2)C)OC4=C(C(=O)C(=C(C4=N3)C(=O)N5CCCC5C(=O)OCC)N)C
Structure:
CAS RN: 82635-60-7
CAS Name: 1-[[8-amino-9-[(2-methoxycarbonyl-1-pyrrolyl)-oxomethyl]-4,6-dimethyl-7-oxo-1-phenoxazinyl]-oxomethyl]-2-pyrrolecarboxylic acid methyl ester
OPENEYE Name: methyl 1-[8-amino-9-(2-methoxycarbonylpyrrole-1-carbonyl)-4,6-dimethyl-7-oxo-phenoxazine-1-carbonyl]pyrrole-2-carboxylate
IUPAC Name: methyl 1-[8-amino-9-(2-methoxycarbonylpyrrole-1-carbonyl)-4,6-dimethyl-7-oxophenoxazine-1-carbonyl]pyrrole-2-carboxylate
SYSTEMATIC NAME: methyl 1-[8-azanyl-9-(2-methoxycarbonylpyrrol-1-yl)carbonyl-4,6-dimethyl-7-oxidanylidene-phenoxazin-1-yl]carbonylpyrrole-2-carboxylate
MOLECULAR FORMULA: C28H22N4O8
MOLECULAR WEIGHT: 542.49628
SMILES: CC1=C2C(=C(C=C1)C(=O)N3C=CC=C3C(=O)OC)N=C4C(=C(C(=O)C(=C4O2)C)N)C(=O)N5C=CC=C5C(=O)OC
Structure:
CAS RN: 82635-61-8
CAS Name: 4-hydroxy-3-methyl-6a,7,8,9-tetrahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepine-6,11-dione
OPENEYE Name: 4-hydroxy-3-methyl-6a,7,8,9-tetrahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepine-6,11-dione
IUPAC Name: 4-hydroxy-3-methyl-6a,7,8,9-tetrahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepine-6,11-dione
SYSTEMATIC NAME: 3-methyl-4-oxidanyl-6a,7,8,9-tetrahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepine-6,11-dione
MOLECULAR FORMULA: C13H14N2O3
MOLECULAR WEIGHT: 246.26186
SMILES: CC1=C(C2=C(C=C1)C(=O)N3CCCC3C(=O)N2)O
Structure:
CAS RN: 82635-57-2
CAS Name: 4-hydroxy-3-methyl-5H-pyrrolo[2,1-c][1,4]benzodiazepine-6,11-dione
OPENEYE Name: 4-hydroxy-3-methyl-5H-pyrrolo[2,1-c][1,4]benzodiazepine-6,11-dione
IUPAC Name: 4-hydroxy-3-methyl-5H-pyrrolo[2,1-c][1,4]benzodiazepine-6,11-dione
SYSTEMATIC NAME: 3-methyl-4-oxidanyl-5H-pyrrolo[2,1-c][1,4]benzodiazepine-6,11-dione
MOLECULAR FORMULA: C13H10N2O3
MOLECULAR WEIGHT: 242.2301
SMILES: CC1=C(C2=C(C=C1)C(=O)N3C=CC=C3C(=O)N2)O
Structure:
CAS RN: 66077-80-3
CAS Name: 2-(1-hydroxy-1-phenyl-5,6,7,8-tetrahydro-2H-thiazolo[3,2-a]benzimidazol-2-yl)acetic acid
OPENEYE Name: 2-(1-hydroxy-1-phenyl-5,6,7,8-tetrahydro-2H-thiazolo[3,2-a]benzimidazol-2-yl)acetic acid
IUPAC Name: 2-(1-hydroxy-1-phenyl-5,6,7,8-tetrahydro-2H-[1,3]thiazolo[3,2-a]benzimidazol-2-yl)acetic acid
SYSTEMATIC NAME: 2-(1-oxidanyl-1-phenyl-5,6,7,8-tetrahydro-2H-[1,3]thiazolo[3,2-a]benzimidazol-2-yl)ethanoic acid
MOLECULAR FORMULA: C17H18N2O3S
MOLECULAR WEIGHT: 330.40142
SMILES: C1CCC2=C(C1)N=C3N2C(C(S3)CC(=O)O)(C4=CC=CC=C4)O
Structure:
CAS RN: 13558-77-5
CAS Name: 2-chloro-N-[(4-methylanilino)-oxomethyl]acetamide
OPENEYE Name: 2-chloro-N-(p-tolylcarbamoyl)acetamide
IUPAC Name: 2-chloro-N-[(4-methylphenyl)carbamoyl]acetamide
SYSTEMATIC NAME: 2-chloranyl-N-[(4-methylphenyl)carbamoyl]ethanamide
MOLECULAR FORMULA: C10H11ClN2O2
MOLECULAR WEIGHT: 226.65954
SMILES: CC1=CC=C(C=C1)NC(=O)NC(=O)CCl
Structure:
CAS RN: 61404-59-9
CAS Name: 3-amino-6-[(3,4,5-trimethoxyphenyl)methyl]-2H-1,2,4-triazin-5-one
OPENEYE Name: 3-amino-6-[(3,4,5-trimethoxyphenyl)methyl]-2H-1,2,4-triazin-5-one
IUPAC Name: 3-amino-6-[(3,4,5-trimethoxyphenyl)methyl]-2H-1,2,4-triazin-5-one
SYSTEMATIC NAME: 3-azanyl-6-[(3,4,5-trimethoxyphenyl)methyl]-2H-1,2,4-triazin-5-one
MOLECULAR FORMULA: C13H16N4O4
MOLECULAR WEIGHT: 292.29054
SMILES: COC1=CC(=CC(=C1OC)OC)CC2=NNC(=NC2=O)N
Structure:
CAS RN: 41808-42-8
CAS Name: 5-amino-3-propan-2-yl-4-isothiazolecarboxamide
OPENEYE Name: 5-amino-3-isopropyl-isothiazole-4-carboxamide
IUPAC Name: 5-amino-3-propan-2-yl-1,2-thiazole-4-carboxamide
SYSTEMATIC NAME: 5-azanyl-3-propan-2-yl-1,2-thiazole-4-carboxamide
MOLECULAR FORMULA: C7H11N3OS
MOLECULAR WEIGHT: 185.24674
SMILES: CC(C)C1=NSC(=C1C(=O)N)N
Structure:
CAS RN: 58361-02-7
CAS Name: 1-[2,6-diamino-5-(4-chlorophenyl)-4-pyrimidinyl]-N-methylethanimine oxide
OPENEYE Name: 1-[2,6-diamino-5-(4-chlorophenyl)pyrimidin-4-yl]-N-methyl-ethanimine oxide
IUPAC Name: 1-[2,6-diamino-5-(4-chlorophenyl)pyrimidin-4-yl]-N-methylethanimine oxide
SYSTEMATIC NAME: 1-[2,6-bis(azanyl)-5-(4-chlorophenyl)pyrimidin-4-yl]-N-methyl-ethanimine oxide
MOLECULAR FORMULA: C13H14ClN5O
MOLECULAR WEIGHT: 291.73616
SMILES: CC(=[N+](C)[O-])C1=C(C(=NC(=N1)N)N)C2=CC=C(C=C2)Cl
Structure:
CAS RN: 58361-00-5
CAS Name: 5-(4-chlorophenyl)-6-[1-(dimethylhydrazinylidene)ethyl]pyrimidine-2,4-diamine
OPENEYE Name: 5-(4-chlorophenyl)-6-[N-(dimethylamino)-C-methyl-carbonimidoyl]pyrimidine-2,4-diamine
IUPAC Name: 5-(4-chlorophenyl)-6-[N-(dimethylamino)-C-methylcarbonimidoyl]pyrimidine-2,4-diamine
SYSTEMATIC NAME: 5-(4-chlorophenyl)-6-[N-(dimethylamino)-C-methyl-carbonimidoyl]pyrimidine-2,4-diamine
MOLECULAR FORMULA: C14H17ClN6
MOLECULAR WEIGHT: 304.77798
SMILES: CC(=NN(C)C)C1=C(C(=NC(=N1)N)N)C2=CC=C(C=C2)Cl
Structure:
CAS RN: 67412-32-2
CAS Name: 1-[2,6-diamino-5-(4-chlorophenyl)-4-pyrimidinyl]ethanol
OPENEYE Name: 1-[2,6-diamino-5-(4-chlorophenyl)pyrimidin-4-yl]ethanol
IUPAC Name: 1-[2,6-diamino-5-(4-chlorophenyl)pyrimidin-4-yl]ethanol
SYSTEMATIC NAME: 1-[2,6-bis(azanyl)-5-(4-chlorophenyl)pyrimidin-4-yl]ethanol
MOLECULAR FORMULA: C12H13ClN4O
MOLECULAR WEIGHT: 264.71082
SMILES: CC(C1=C(C(=NC(=N1)N)N)C2=CC=C(C=C2)Cl)O
Structure:
CAS RN: 60586-30-3
CAS Name: (4-chlorophenyl)-pyridin-4-yl-thiophen-2-ylmethanol
OPENEYE Name: (4-chlorophenyl)-(4-pyridyl)-(2-thienyl)methanol
IUPAC Name: (4-chlorophenyl)-pyridin-4-yl-thiophen-2-ylmethanol
SYSTEMATIC NAME: (4-chlorophenyl)-pyridin-4-yl-thiophen-2-yl-methanol
MOLECULAR FORMULA: C16H12ClNOS
MOLECULAR WEIGHT: 301.79058
SMILES: C1=CSC(=C1)C(C2=CC=C(C=C2)Cl)(C3=CC=NC=C3)O
Structure:
CAS RN: 60586-19-8
CAS Name: 1-[diphenyl(thiophen-2-yl)methyl]piperidine
OPENEYE Name: 1-[diphenyl(2-thienyl)methyl]piperidine
IUPAC Name: 1-[diphenyl(thiophen-2-yl)methyl]piperidine
SYSTEMATIC NAME: 1-[diphenyl(thiophen-2-yl)methyl]piperidine
MOLECULAR FORMULA: C22H23NS
MOLECULAR WEIGHT: 333.48972
SMILES: C1CCN(CC1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CS4
Structure:
CAS RN: 83379-25-3
CAS Name: 4-methylbenzenesulfonic acid [2-(4-amino-6-bromo-5-cyano-7-pyrrolo[2,3-d]pyrimidinyl)-4-hydroxy-5-(hydroxymethyl)-3-oxolanyl] ester
OPENEYE Name: [2-(4-amino-6-bromo-5-cyano-pyrrolo[2,3-d]pyrimidin-7-yl)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-3-yl] 4-methylbenzenesulfonate
IUPAC Name: [2-(4-amino-6-bromo-5-cyanopyrrolo[2,3-d]pyrimidin-7-yl)-4-hydroxy-5-(hydroxymethyl)oxolan-3-yl] 4-methylbenzenesulfonate
SYSTEMATIC NAME: [2-(4-azanyl-6-bromanyl-5-cyano-pyrrolo[2,3-d]pyrimidin-7-yl)-5-(hydroxymethyl)-4-oxidanyl-oxolan-3-yl] 4-methylbenzenesulfonate
MOLECULAR FORMULA: C19H18BrN5O6S
MOLECULAR WEIGHT: 524.34512
SMILES: CC1=CC=C(C=C1)S(=O)(=O)OC2C(C(OC2N3C4=C(C(=C3Br)C#N)C(=NC=N4)N)CO)O
Structure:
CAS RN: 22095-98-3
CAS Name: 4-aminobenzoic acid [4-[(4-aminophenyl)-oxomethoxy]phenyl] ester
OPENEYE Name: [4-(4-aminobenzoyl)oxyphenyl] 4-aminobenzoate
IUPAC Name: [4-(4-aminobenzoyl)oxyphenyl] 4-aminobenzoate
SYSTEMATIC NAME: [4-(4-aminophenyl)carbonyloxyphenyl] 4-azanylbenzoate
MOLECULAR FORMULA: C20H16N2O4
MOLECULAR WEIGHT: 348.35204
SMILES: C1=CC(=CC=C1C(=O)OC2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)N)N
Structure:
CAS RN: 59138-64-6
CAS Name: 4-aminobenzoic acid [4-[(4-hexoxyphenyl)-oxomethoxy]phenyl] ester
OPENEYE Name: [4-(4-hexoxybenzoyl)oxyphenyl] 4-aminobenzoate
IUPAC Name: [4-(4-hexoxybenzoyl)oxyphenyl] 4-aminobenzoate
SYSTEMATIC NAME: [4-(4-hexoxyphenyl)carbonyloxyphenyl] 4-azanylbenzoate
MOLECULAR FORMULA: C26H27NO5
MOLECULAR WEIGHT: 433.49628
SMILES: CCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)N
Structure:
No comments:
Post a Comment