Wednesday, December 28, 2011

http://ChemLookup.com Compounds




CAS RN: 6457-97-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H14FN3OS
MOLECULAR WEIGHT: 351.397363
SMILES: CC1=CC(=NC2=C1C3=C(S2)C(C(=C(O3)N)C#N)C4=CC=C(C=C4)F)C
Structure:

CAS RN: 5986-35-6
CAS Name: 3-[1-[[2-(2-chlorophenyl)-5-(1-methyl-2-pyrrolyl)-3-pyrazolyl]-oxomethyl]-4-piperidinyl]-1H-benzimidazol-2-one
OPENEYE Name: 3-[1-[2-(2-chlorophenyl)-5-(1-methylpyrrol-2-yl)pyrazole-3-carbonyl]-4-piperidyl]-1H-benzimidazol-2-one
IUPAC Name: 3-[1-[2-(2-chlorophenyl)-5-(1-methylpyrrol-2-yl)pyrazole-3-carbonyl]piperidin-4-yl]-1H-benzimidazol-2-one
SYSTEMATIC NAME: 3-[1-[2-(2-chlorophenyl)-5-(1-methylpyrrol-2-yl)pyrazol-3-yl]carbonylpiperidin-4-yl]-1H-benzimidazol-2-one
MOLECULAR FORMULA: C27H25ClN6O2
MOLECULAR WEIGHT: 500.9794
SMILES: CN1C=CC=C1C2=NN(C(=C2)C(=O)N3CCC(CC3)N4C5=CC=CC=C5NC4=O)C6=CC=CC=C6Cl
Structure:

CAS RN: 5979-61-3
CAS Name: 1-butyl-3-(2,3-dichlorophenyl)-1-[2-[4-(4-methylphenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]urea
OPENEYE Name: 1-butyl-3-(2,3-dichlorophenyl)-1-[2-oxo-2-[4-(p-tolyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]ethyl]urea
IUPAC Name: 1-butyl-3-(2,3-dichlorophenyl)-1-[2-[4-(4-methylphenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]urea
SYSTEMATIC NAME: 3-[2,3-bis(chloranyl)phenyl]-1-butyl-1-[2-[4-(4-methylphenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxidanylidene-ethyl]urea
MOLECULAR FORMULA: C31H30Cl2N4O2
MOLECULAR WEIGHT: 561.5015
SMILES: CCCCN(CC(=O)N1C(C2=CC=CN2C3=CC=CC=C31)C4=CC=C(C=C4)C)C(=O)NC5=C(C(=CC=C5)Cl)Cl
Structure:

CAS RN: 4534-97-8
CAS Name: N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylideneamino]-2-thiophen-2-ylacetamide
OPENEYE Name: N-(1-tetralin-6-ylethylideneamino)-2-(2-thienyl)acetamide
IUPAC Name: N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylideneamino]-2-thiophen-2-ylacetamide
SYSTEMATIC NAME: N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylideneamino]-2-thiophen-2-yl-ethanamide
MOLECULAR FORMULA: C18H20N2OS
MOLECULAR WEIGHT: 312.4292
SMILES: CC(=NNC(=O)CC1=CC=CS1)C2=CC3=C(CCCC3)C=C2
Structure:

CAS RN: 4534-36-5
CAS Name: 3-(3,5-ditert-butyl-4-hydroxyphenyl)-N-[(2-phenylmethoxyphenyl)methylideneamino]propanamide
OPENEYE Name: N-[(2-benzyloxyphenyl)methyleneamino]-3-(3,5-ditert-butyl-4-hydroxy-phenyl)propanamide
IUPAC Name: 3-(3,5-ditert-butyl-4-hydroxyphenyl)-N-[(2-phenylmethoxyphenyl)methylideneamino]propanamide
SYSTEMATIC NAME: 3-(3,5-ditert-butyl-4-oxidanyl-phenyl)-N-[(2-phenylmethoxyphenyl)methylideneamino]propanamide
MOLECULAR FORMULA: C31H38N2O3
MOLECULAR WEIGHT: 486.64502
SMILES: CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)NN=CC2=CC=CC=C2OCC3=CC=CC=C3
Structure:

CAS RN: 4531-30-0
CAS Name: 1-[(propan-2-ylamino)-propan-2-yliminomethyl]-3-[2-(trifluoromethyl)phenyl]urea
OPENEYE Name: 1-(N,N'-diisopropylcarbamimidoyl)-3-[2-(trifluoromethyl)phenyl]urea
IUPAC Name: 1-[N,N'-di(propan-2-yl)carbamimidoyl]-3-[2-(trifluoromethyl)phenyl]urea
SYSTEMATIC NAME: 1-[N,N'-di(propan-2-yl)carbamimidoyl]-3-[2-(trifluoromethyl)phenyl]urea
MOLECULAR FORMULA: C15H21F3N4O
MOLECULAR WEIGHT: 330.34865
SMILES: CC(C)NC(=NC(C)C)NC(=O)NC1=CC=CC=C1C(F)(F)F
Structure:

CAS RN: 6730-41-2
CAS Name: (3-nitrophenyl)-(2,4,6-trimethylphenyl)sulfonylazanide
OPENEYE Name: (3-nitrophenyl)-(2,4,6-trimethylphenyl)sulfonyl-azanide
IUPAC Name: (3-nitrophenyl)-(2,4,6-trimethylphenyl)sulfonylazanide
SYSTEMATIC NAME: (3-nitrophenyl)-(2,4,6-trimethylphenyl)sulfonyl-azanide
MOLECULAR FORMULA: C15H15N2O4S-
MOLECULAR WEIGHT: 319.3556
SMILES: CC1=CC(=C(C(=C1)C)S(=O)(=O)[N-]C2=CC(=CC=C2)[N+](=O)[O-])C
Structure:

CAS RN: 5000-89-5
CAS Name: 1-[(4-ethoxy-3-methoxyphenyl)-thiophen-2-ylmethyl]piperazine
OPENEYE Name: 1-[(4-ethoxy-3-methoxy-phenyl)-(2-thienyl)methyl]piperazine
IUPAC Name: 1-[(4-ethoxy-3-methoxyphenyl)-thiophen-2-ylmethyl]piperazine
SYSTEMATIC NAME: 1-[(4-ethoxy-3-methoxy-phenyl)-thiophen-2-yl-methyl]piperazine
MOLECULAR FORMULA: C18H24N2O2S
MOLECULAR WEIGHT: 332.46036
SMILES: CCOC1=C(C=C(C=C1)C(C2=CC=CS2)N3CCNCC3)OC
Structure:

CAS RN: 5000-28-2
CAS Name: 3-[(4-ethoxyphenyl)-(1-piperazinyl)methyl]quinoline
OPENEYE Name: 3-[(4-ethoxyphenyl)-piperazin-1-yl-methyl]quinoline
IUPAC Name: 3-[(4-ethoxyphenyl)-piperazin-1-ylmethyl]quinoline
SYSTEMATIC NAME: 3-[(4-ethoxyphenyl)-piperazin-1-yl-methyl]quinoline
MOLECULAR FORMULA: C22H25N3O
MOLECULAR WEIGHT: 347.4534
SMILES: CCOC1=CC=C(C=C1)C(C2=CC3=CC=CC=C3N=C2)N4CCNCC4
Structure:

CAS RN: 6399-47-9
CAS Name: 2-chloro-N-(2H-tetrazol-5-yl)acetamide
OPENEYE Name: 2-chloro-N-(2H-tetrazol-5-yl)acetamide
IUPAC Name: 2-chloro-N-(2H-tetrazol-5-yl)acetamide
SYSTEMATIC NAME: 2-chloranyl-N-(2H-1,2,3,4-tetrazol-5-yl)ethanamide
MOLECULAR FORMULA: C3H4ClN5O
MOLECULAR WEIGHT: 161.54976
SMILES: C(C(=O)NC1=NNN=N1)Cl
Structure:

CAS RN: 6396-41-4
CAS Name: 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoro-N-(2-pyridinyl)heptanamide
OPENEYE Name: 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoro-N-(2-pyridyl)heptanamide
IUPAC Name: 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoro-N-pyridin-2-ylheptanamide
SYSTEMATIC NAME: 2,2,3,3,4,4,5,5,6,6,7,7-dodecakis(fluoranyl)-N-pyridin-2-yl-heptanamide
MOLECULAR FORMULA: C12H6F12N2O
MOLECULAR WEIGHT: 422.169678
SMILES: C1=CC=NC(=C1)NC(=O)C(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
Structure:

CAS RN: 5911-14-8
CAS Name: N-(2-furanylmethyl)-N-(phenylmethyl)hexanamide
OPENEYE Name: N-benzyl-N-(2-furylmethyl)hexanamide
IUPAC Name: N-benzyl-N-(furan-2-ylmethyl)hexanamide
SYSTEMATIC NAME: N-(furan-2-ylmethyl)-N-(phenylmethyl)hexanamide
MOLECULAR FORMULA: C18H23NO2
MOLECULAR WEIGHT: 285.38072
SMILES: CCCCCC(=O)N(CC1=CC=CC=C1)CC2=CC=CO2
Structure:

CAS RN: 5518-75-2
CAS Name: N-[[1-(2-methylphenyl)-2,4,6-trioxo-1,3-diazinan-5-yl]methylideneamino]-4-nitrobenzamide
OPENEYE Name: 4-nitro-N-[[1-(o-tolyl)-2,4,6-trioxo-hexahydropyrimidin-5-yl]methyleneamino]benzamide
IUPAC Name: N-[[1-(2-methylphenyl)-2,4,6-trioxo-1,3-diazinan-5-yl]methylideneamino]-4-nitrobenzamide
SYSTEMATIC NAME: N-[[1-(2-methylphenyl)-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-yl]methylideneamino]-4-nitro-benzamide
MOLECULAR FORMULA: C19H15N5O6
MOLECULAR WEIGHT: 409.3523
SMILES: CC1=CC=CC=C1N2C(=O)C(C(=O)NC2=O)C=NNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]
Structure:

CAS RN: 6882-18-4
CAS Name: N-(4-chloro-2-methylphenyl)-3-[4-[(2,6-dichlorophenyl)methoxy]-3-methoxyphenyl]-2-propenamide
OPENEYE Name: N-(4-chloro-2-methyl-phenyl)-3-[4-[(2,6-dichlorophenyl)methoxy]-3-methoxy-phenyl]prop-2-enamide
IUPAC Name: N-(4-chloro-2-methylphenyl)-3-[4-[(2,6-dichlorophenyl)methoxy]-3-methoxyphenyl]prop-2-enamide
SYSTEMATIC NAME: 3-[4-[[2,6-bis(chloranyl)phenyl]methoxy]-3-methoxy-phenyl]-N-(4-chloranyl-2-methyl-phenyl)prop-2-enamide
MOLECULAR FORMULA: C24H20Cl3NO3
MOLECULAR WEIGHT: 476.7795
SMILES: CC1=C(C=CC(=C1)Cl)NC(=O)C=CC2=CC(=C(C=C2)OCC3=C(C=CC=C3Cl)Cl)OC
Structure:

CAS RN: 4808-98-4
CAS Name: N-[[1-(2-anilino-2-oxoethyl)-3-indolyl]methylideneamino]-4-pyridinecarboxamide
OPENEYE Name: N-[[1-(2-anilino-2-oxo-ethyl)indol-3-yl]methyleneamino]pyridine-4-carboxamide
IUPAC Name: N-[[1-(2-anilino-2-oxoethyl)indol-3-yl]methylideneamino]pyridine-4-carboxamide
SYSTEMATIC NAME: N-[[1-(2-oxidanylidene-2-phenylazanyl-ethyl)indol-3-yl]methylideneamino]pyridine-4-carboxamide
MOLECULAR FORMULA: C23H19N5O2
MOLECULAR WEIGHT: 397.42926
SMILES: C1=CC=C(C=C1)NC(=O)CN2C=C(C3=CC=CC=C32)C=NNC(=O)C4=CC=NC=C4
Structure:

CAS RN: 6521-43-3
CAS Name: 2-(2-methyl-5-nitro-1-imidazolyl)-1-cyclododecanone oxime
OPENEYE Name: 2-(2-methyl-5-nitro-imidazol-1-yl)cyclododecanone oxime
IUPAC Name: N-[2-(2-methyl-5-nitroimidazol-1-yl)cyclododecylidene]hydroxylamine
SYSTEMATIC NAME: N-[2-(2-methyl-5-nitro-imidazol-1-yl)cyclododecylidene]hydroxylamine
MOLECULAR FORMULA: C16H26N4O3
MOLECULAR WEIGHT: 322.40264
SMILES: CC1=NC=C(N1C2CCCCCCCCCCC2=NO)[N+](=O)[O-]
Structure:

CAS RN: 6806-78-6
CAS Name: 1-[(1'-acetyl-6-hydroxy-4-spiro[1-benzopyran-2,4'-piperidine]yl)amino]-3-(2-fluorophenyl)thiourea
OPENEYE Name: 1-[(1'-acetyl-6-hydroxy-spiro[chromene-2,4'-piperidine]-4-yl)amino]-3-(2-fluorophenyl)thiourea
IUPAC Name: 1-[(1'-acetyl-6-hydroxyspiro[chromene-2,4'-piperidine]-4-yl)amino]-3-(2-fluorophenyl)thiourea
SYSTEMATIC NAME: 1-[(1'-ethanoyl-6-oxidanyl-spiro[chromene-2,4'-piperidine]-4-yl)amino]-3-(2-fluorophenyl)thiourea
MOLECULAR FORMULA: C22H23FN4O3S
MOLECULAR WEIGHT: 442.506423
SMILES: CC(=O)N1CCC2(CC1)C=C(C3=C(O2)C=CC(=C3)O)NNC(=S)NC4=CC=CC=C4F
Structure:

CAS RN: 6550-89-6
CAS Name: N-[5-(diethylsulfamoyl)-2-(4-morpholinyl)phenyl]-4-methylbenzamide
OPENEYE Name: N-[5-(diethylsulfamoyl)-2-morpholino-phenyl]-4-methyl-benzamide
IUPAC Name: N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-4-methylbenzamide
SYSTEMATIC NAME: N-[5-(diethylsulfamoyl)-2-morpholin-4-yl-phenyl]-4-methyl-benzamide
MOLECULAR FORMULA: C22H29N3O4S
MOLECULAR WEIGHT: 431.54836
SMILES: CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCOCC2)NC(=O)C3=CC=C(C=C3)C
Structure:

CAS RN: 6550-28-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H25O8P
MOLECULAR WEIGHT: 424.381461
SMILES: CCOP1(=O)OC2=CC=CC=C2OCCOCCOCCOC3=CC=CC=C3O1
Structure:

CAS RN: 6415-44-7
CAS Name: 2-[4-[[4-[4-[[4-[2-oxo-2-(1-piperidinyl)ethoxy]phenyl]methylideneamino]phenyl]phenyl]iminomethyl]phenoxy]-1-(1-piperidinyl)ethanone
OPENEYE Name: 2-[4-[[4-[4-[[4-[2-oxo-2-(1-piperidyl)ethoxy]phenyl]methyleneamino]phenyl]phenyl]iminomethyl]phenoxy]-1-(1-piperidyl)ethanone
IUPAC Name: 2-[4-[[4-[4-[[4-(2-oxo-2-piperidin-1-ylethoxy)phenyl]methylideneamino]phenyl]phenyl]iminomethyl]phenoxy]-1-piperidin-1-ylethanone
SYSTEMATIC NAME: 2-[4-[[4-[4-[[4-(2-oxidanylidene-2-piperidin-1-yl-ethoxy)phenyl]methylideneamino]phenyl]phenyl]iminomethyl]phenoxy]-1-piperidin-1-yl-ethanone
MOLECULAR FORMULA: C40H42N4O4
MOLECULAR WEIGHT: 642.78588
SMILES: C1CCN(CC1)C(=O)COC2=CC=C(C=C2)C=NC3=CC=C(C=C3)C4=CC=C(C=C4)N=CC5=CC=C(C=C5)OCC(=O)N6CCCCC6
Structure:

CAS RN: 6873-57-0
CAS Name: N-(4-methoxyphenyl)-N-(4-methylphenyl)sulfonyl-3-phenyl-2-propenamide
OPENEYE Name: N-(4-methoxyphenyl)-3-phenyl-N-(p-tolylsulfonyl)prop-2-enamide
IUPAC Name: N-(4-methoxyphenyl)-N-(4-methylphenyl)sulfonyl-3-phenylprop-2-enamide
SYSTEMATIC NAME: N-(4-methoxyphenyl)-N-(4-methylphenyl)sulfonyl-3-phenyl-prop-2-enamide
MOLECULAR FORMULA: C23H21NO4S
MOLECULAR WEIGHT: 407.48214
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N(C2=CC=C(C=C2)OC)C(=O)C=CC3=CC=CC=C3
Structure:

CAS RN: 6873-56-9
CAS Name: N,3-bis(4-methoxyphenyl)-N-(4-methylphenyl)sulfonyl-2-propenamide
OPENEYE Name: N,3-bis(4-methoxyphenyl)-N-(p-tolylsulfonyl)prop-2-enamide
IUPAC Name: N,3-bis(4-methoxyphenyl)-N-(4-methylphenyl)sulfonylprop-2-enamide
SYSTEMATIC NAME: N,3-bis(4-methoxyphenyl)-N-(4-methylphenyl)sulfonyl-prop-2-enamide
MOLECULAR FORMULA: C24H23NO5S
MOLECULAR WEIGHT: 437.50812
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N(C2=CC=C(C=C2)OC)C(=O)C=CC3=CC=C(C=C3)OC
Structure:

CAS RN: 6026-74-0
CAS Name: 2-[[butylamino(oxo)methyl]-cyclopropylamino]-N-[(4-fluorophenyl)methyl]-N-[(3-methyl-2-thiophenyl)methyl]acetamide
OPENEYE Name: 2-[butylcarbamoyl(cyclopropyl)amino]-N-[(4-fluorophenyl)methyl]-N-[(3-methyl-2-thienyl)methyl]acetamide
IUPAC Name: 2-[butylcarbamoyl(cyclopropyl)amino]-N-[(4-fluorophenyl)methyl]-N-[(3-methylthiophen-2-yl)methyl]acetamide
SYSTEMATIC NAME: 2-[butylcarbamoyl(cyclopropyl)amino]-N-[(4-fluorophenyl)methyl]-N-[(3-methylthiophen-2-yl)methyl]ethanamide
MOLECULAR FORMULA: C23H30FN3O2S
MOLECULAR WEIGHT: 431.566603
SMILES: CCCCNC(=O)N(CC(=O)N(CC1=CC=C(C=C1)F)CC2=C(C=CS2)C)C3CC3
Structure:

CAS RN: 4986-57-6
CAS Name: 1-[(5-chloro-2-thiophenyl)-(3,4-dimethoxyphenyl)methyl]-1,4-diazepane
OPENEYE Name: 1-[(5-chloro-2-thienyl)-(3,4-dimethoxyphenyl)methyl]-1,4-diazepane
IUPAC Name: 1-[(5-chlorothiophen-2-yl)-(3,4-dimethoxyphenyl)methyl]-1,4-diazepane
SYSTEMATIC NAME: 1-[(5-chloranylthiophen-2-yl)-(3,4-dimethoxyphenyl)methyl]-1,4-diazepane
MOLECULAR FORMULA: C18H23ClN2O2S
MOLECULAR WEIGHT: 366.90542
SMILES: COC1=C(C=C(C=C1)C(C2=CC=C(S2)Cl)N3CCCNCC3)OC
Structure:

CAS RN: 5499-83-2
CAS Name: N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-4-(1-oxopropylamino)benzamide
OPENEYE Name: N-[5-(diethylsulfamoyl)-2-methoxy-phenyl]-4-(propanoylamino)benzamide
IUPAC Name: N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-4-(propanoylamino)benzamide
SYSTEMATIC NAME: N-[5-(diethylsulfamoyl)-2-methoxy-phenyl]-4-(propanoylamino)benzamide
MOLECULAR FORMULA: C21H27N3O5S
MOLECULAR WEIGHT: 433.52118
SMILES: CCC(=O)NC1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N(CC)CC)OC
Structure:

CAS RN: 5985-70-6
CAS Name: [2-(3,4-dichlorophenyl)-5-(1-methyl-2-pyrrolyl)-3-pyrazolyl]-(1-piperidinyl)methanone
OPENEYE Name: [2-(3,4-dichlorophenyl)-5-(1-methylpyrrol-2-yl)pyrazol-3-yl]-(1-piperidyl)methanone
IUPAC Name: [2-(3,4-dichlorophenyl)-5-(1-methylpyrrol-2-yl)pyrazol-3-yl]-piperidin-1-ylmethanone
SYSTEMATIC NAME: [2-(3,4-dichlorophenyl)-5-(1-methylpyrrol-2-yl)pyrazol-3-yl]-piperidin-1-yl-methanone
MOLECULAR FORMULA: C20H20Cl2N4O
MOLECULAR WEIGHT: 403.305
SMILES: CN1C=CC=C1C2=NN(C(=C2)C(=O)N3CCCCC3)C4=CC(=C(C=C4)Cl)Cl
Structure:

CAS RN: 4871-25-4
CAS Name: [4-(4-methoxyphenyl)-2-thiazolyl]hydrazine
OPENEYE Name: [4-(4-methoxyphenyl)thiazol-2-yl]hydrazine
IUPAC Name: [4-(4-methoxyphenyl)-1,3-thiazol-2-yl]hydrazine
SYSTEMATIC NAME: [4-(4-methoxyphenyl)-1,3-thiazol-2-yl]diazane
MOLECULAR FORMULA: C10H11N3OS
MOLECULAR WEIGHT: 221.27884
SMILES: COC1=CC=C(C=C1)C2=CSC(=N2)NN
Structure:

CAS RN: 5793-83-9
CAS Name: 1-(4-chloro-3-nitrophenyl)-N-[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]methanimine
OPENEYE Name: 1-(4-chloro-3-nitro-phenyl)-N-[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]methanimine
IUPAC Name: 1-(4-chloro-3-nitrophenyl)-N-[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]methanimine
SYSTEMATIC NAME: 1-(4-chloranyl-3-nitro-phenyl)-N-[2-(3-iodanylphenyl)-1,3-benzoxazol-5-yl]methanimine
MOLECULAR FORMULA: C20H11ClIN3O3
MOLECULAR WEIGHT: 503.67711
SMILES: C1=CC(=CC(=C1)I)C2=NC3=C(O2)C=CC(=C3)N=CC4=CC(=C(C=C4)Cl)[N+](=O)[O-]
Structure:

CAS RN: 5793-22-6
CAS Name: N2-[[4-(dimethylamino)phenyl]methylideneamino]-6-(4-morpholinyl)-N4-(3-nitrophenyl)-1,3,5-triazine-2,4-diamine
OPENEYE Name: N2-[[4-(dimethylamino)phenyl]methyleneamino]-6-morpholino-N4-(3-nitrophenyl)-1,3,5-triazine-2,4-diamine
IUPAC Name: 2-N-[[4-(dimethylamino)phenyl]methylideneamino]-6-morpholin-4-yl-4-N-(3-nitrophenyl)-1,3,5-triazine-2,4-diamine
SYSTEMATIC NAME: N2-[[4-(dimethylamino)phenyl]methylideneamino]-6-morpholin-4-yl-N4-(3-nitrophenyl)-1,3,5-triazine-2,4-diamine
MOLECULAR FORMULA: C22H25N9O3
MOLECULAR WEIGHT: 463.4924
SMILES: CN(C)C1=CC=C(C=C1)C=NNC2=NC(=NC(=N2)NC3=CC(=CC=C3)[N+](=O)[O-])N4CCOCC4
Structure:

CAS RN: 6422-27-1
CAS Name: 6-(4-methylanilino)-4-oxo-6-phenylhexanoic acid
OPENEYE Name: 6-(4-methylanilino)-4-oxo-6-phenyl-hexanoic acid
IUPAC Name: 6-(4-methylanilino)-4-oxo-6-phenylhexanoic acid
SYSTEMATIC NAME: 6-[(4-methylphenyl)amino]-4-oxidanylidene-6-phenyl-hexanoic acid
MOLECULAR FORMULA: C19H21NO3
MOLECULAR WEIGHT: 311.37494
SMILES: CC1=CC=C(C=C1)NC(CC(=O)CCC(=O)O)C2=CC=CC=C2
Structure:

CAS RN: 4805-77-0
CAS Name: 3-(2-fluorophenyl)-10-methyl-6-propyl-2,4-dihydropyrano[3,2-g][1,3]benzoxazin-8-one
OPENEYE Name: 3-(2-fluorophenyl)-10-methyl-6-propyl-2,4-dihydropyrano[3,2-g][1,3]benzoxazin-8-one
IUPAC Name: 3-(2-fluorophenyl)-10-methyl-6-propyl-2,4-dihydropyrano[3,2-g][1,3]benzoxazin-8-one
SYSTEMATIC NAME: 3-(2-fluorophenyl)-10-methyl-6-propyl-2,4-dihydropyrano[3,2-g][1,3]benzoxazin-8-one
MOLECULAR FORMULA: C21H20FNO3
MOLECULAR WEIGHT: 353.386803
SMILES: CCCC1=CC(=O)OC2=C(C3=C(CN(CO3)C4=CC=CC=C4F)C=C12)C
Structure:

CAS RN: 4800-86-6
CAS Name: 2-(2-methyl-1H-indol-3-yl)-4-oxo-N,1-bis(3,4,5-trimethoxyphenyl)-2-azetidinecarboxamide
OPENEYE Name: 2-(2-methyl-1H-indol-3-yl)-4-oxo-N,1-bis(3,4,5-trimethoxyphenyl)azetidine-2-carboxamide
IUPAC Name: 2-(2-methyl-1H-indol-3-yl)-4-oxo-N,1-bis(3,4,5-trimethoxyphenyl)azetidine-2-carboxamide
SYSTEMATIC NAME: 2-(2-methyl-1H-indol-3-yl)-4-oxidanylidene-N,1-bis(3,4,5-trimethoxyphenyl)azetidine-2-carboxamide
MOLECULAR FORMULA: C31H33N3O8
MOLECULAR WEIGHT: 575.60902
SMILES: CC1=C(C2=CC=CC=C2N1)C3(CC(=O)N3C4=CC(=C(C(=C4)OC)OC)OC)C(=O)NC5=CC(=C(C(=C5)OC)OC)OC
Structure:

CAS RN: 6734-49-2
CAS Name: N-[4-[(4-methoxyphenyl)sulfonylamino]phenyl]ethanimidate
OPENEYE Name: N-[4-[(4-methoxyphenyl)sulfonylamino]phenyl]ethanimidate
IUPAC Name: N-[4-[(4-methoxyphenyl)sulfonylamino]phenyl]ethanimidate
SYSTEMATIC NAME: N-[4-[(4-methoxyphenyl)sulfonylamino]phenyl]ethanimidate
MOLECULAR FORMULA: C15H15N2O4S-
MOLECULAR WEIGHT: 319.3556
SMILES: CC(=NC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)OC)[O-]
Structure:

CAS RN: 6706-79-2
CAS Name: 1-(2,4-dichloro-5-methylphenyl)sulfonylbenzimidazole
OPENEYE Name: 1-(2,4-dichloro-5-methyl-phenyl)sulfonylbenzimidazole
IUPAC Name: 1-(2,4-dichloro-5-methylphenyl)sulfonylbenzimidazole
SYSTEMATIC NAME: 1-[2,4-bis(chloranyl)-5-methyl-phenyl]sulfonylbenzimidazole
MOLECULAR FORMULA: C14H10Cl2N2O2S
MOLECULAR WEIGHT: 341.2124
SMILES: CC1=CC(=C(C=C1Cl)Cl)S(=O)(=O)N2C=NC3=CC=CC=C32
Structure:

CAS RN: 6706-78-1
CAS Name: 2-(2-naphthalenyloxymethyl)-3-propan-2-yl-1H-benzimidazol-3-ium
OPENEYE Name: 3-isopropyl-2-(2-naphthyloxymethyl)-1H-benzimidazol-3-ium
IUPAC Name: 2-(naphthalen-2-yloxymethyl)-3-propan-2-yl-1H-benzimidazol-3-ium
SYSTEMATIC NAME: 2-(naphthalen-2-yloxymethyl)-3-propan-2-yl-1H-benzimidazol-3-ium
MOLECULAR FORMULA: C21H21N2O+
MOLECULAR WEIGHT: 317.40424
SMILES: CC(C)[N+]1=C(NC2=CC=CC=C21)COC3=CC4=CC=CC=C4C=C3
Structure:

CAS RN: 6251-78-1
CAS Name: 2-[[2-[2-[(6-chloro-3-methyl-1,3-benzothiazol-2-ylidene)amino]-2-oxoethyl]sulfonyl-1-oxoethyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylic acid methyl ester
OPENEYE Name: methyl 2-[[2-[2-[(6-chloro-3-methyl-1,3-benzothiazol-2-ylidene)amino]-2-oxo-ethyl]sulfonylacetyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
IUPAC Name: methyl 2-[[2-[2-[(6-chloro-3-methyl-1,3-benzothiazol-2-ylidene)amino]-2-oxoethyl]sulfonylacetyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
SYSTEMATIC NAME: methyl 2-[2-[2-[(6-chloranyl-3-methyl-1,3-benzothiazol-2-ylidene)amino]-2-oxidanylidene-ethyl]sulfonylethanoylamino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
MOLECULAR FORMULA: C23H24ClN3O6S3
MOLECULAR WEIGHT: 570.10116
SMILES: CN1C2=C(C=C(C=C2)Cl)SC1=NC(=O)CS(=O)(=O)CC(=O)NC3=C(C4=C(S3)CCCCC4)C(=O)OC
Structure:

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