Wednesday, January 25, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 1-[(1,2-dimethylindol-5-yl)methyl]-3-(o-tolyl)thiourea
CAS Name: 1-[(1,2-dimethyl-5-indolyl)methyl]-3-(2-methylphenyl)thiourea
IUPAC NAME: 1-[(1,2-dimethylindol-5-yl)methyl]-3-(2-methylphenyl)thiourea
SYSTEMATIC NAME: 1-[(1,2-dimethylindol-5-yl)methyl]-3-(2-methylphenyl)thiourea
MOLECULAR FORMULA: C19H21N3S
MOLECULAR WEIGHT: 323.45514
SMILES: CC1=CC=CC=C1NC(=S)NCC2=CC3=C(C=C2)N(C(=C3)C)C
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Product OPENEYE NAME: 4-[(3,5-dimethyl-1-piperidyl)sulfonyl]-N-[4-[2-[[4-[(3,5-dimethyl-1-piperidyl)sulfonyl]benzoyl]amino]thiazol-4-yl]thiazol-2-yl]benzamide
CAS Name: 4-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-N-[4-[2-[[[4-[(3,5-dimethyl-1-piperidinyl)sulfonyl]phenyl]-oxomethyl]amino]-4-thiazolyl]-2-thiazolyl]benzamide
IUPAC NAME: 4-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-[4-[2-[[4-(3,5-dimethylpiperidin-1-yl)sulfonylbenzoyl]amino]-1,3-thiazol-4-yl]-1,3-thiazol-2-yl]benzamide
SYSTEMATIC NAME: 4-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-[4-[2-[[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]carbonylamino]-1,3-thiazol-4-yl]-1,3-thiazol-2-yl]benzamide
MOLECULAR FORMULA: C34H40N6O6S4
MOLECULAR WEIGHT: 756.978
SMILES: CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NC(=CS3)C4=CSC(=N4)NC(=O)C5=CC=C(C=C5)S(=O)(=O)N6CC(CC(C6)C)C)C
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Product OPENEYE NAME: 2,5-dichloro-N-[5-(4-nitrophenyl)sulfonylthiazol-2-yl]thiophene-3-carboxamide
CAS Name: 2,5-dichloro-N-[5-(4-nitrophenyl)sulfonyl-2-thiazolyl]-3-thiophenecarboxamide
IUPAC NAME: 2,5-dichloro-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]thiophene-3-carboxamide
SYSTEMATIC NAME: 2,5-bis(chloranyl)-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]thiophene-3-carboxamide
MOLECULAR FORMULA: C14H7Cl2N3O5S3
MOLECULAR WEIGHT: 464.32348
SMILES: C1=CC(=CC=C1[N+](=O)[O-])S(=O)(=O)C2=CN=C(S2)NC(=O)C3=C(SC(=C3)Cl)Cl
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Product OPENEYE NAME: N-(1,3-benzothiazol-2-yl)-6-[5-[(4-methoxyphenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]hexanamide
CAS Name: N-(1,3-benzothiazol-2-yl)-6-[5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]hexanamide
IUPAC NAME: N-(1,3-benzothiazol-2-yl)-6-[5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanamide
SYSTEMATIC NAME: N-(1,3-benzothiazol-2-yl)-6-[5-[(4-methoxyphenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanamide
MOLECULAR FORMULA: C24H23N3O3S3
MOLECULAR WEIGHT: 497.65272
SMILES: COC1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CCCCCC(=O)NC3=NC4=CC=CC=C4S3
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Product OPENEYE NAME: ethyl 2-[4-[butyl(methyl)sulfamoyl]benzoyl]imino-3,4-dimethyl-thiazole-5-carboxylate
CAS Name: 2-[[4-[butyl(methyl)sulfamoyl]phenyl]-oxomethyl]imino-3,4-dimethyl-5-thiazolecarboxylic acid ethyl ester
IUPAC NAME: ethyl 2-[4-[butyl(methyl)sulfamoyl]benzoyl]imino-3,4-dimethyl-1,3-thiazole-5-carboxylate
SYSTEMATIC NAME: ethyl 2-[4-[butyl(methyl)sulfamoyl]phenyl]carbonylimino-3,4-dimethyl-1,3-thiazole-5-carboxylate
MOLECULAR FORMULA: C20H27N3O5S2
MOLECULAR WEIGHT: 453.57548
SMILES: CCCCN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)N=C2N(C(=C(S2)C(=O)OCC)C)C
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Product OPENEYE NAME: 1-[2-[3-(trifluoromethyl)phenyl]thiazolidin-3-yl]nonan-1-one
CAS Name: 1-[2-[3-(trifluoromethyl)phenyl]-3-thiazolidinyl]-1-nonanone
IUPAC NAME: 1-[2-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-3-yl]nonan-1-one
SYSTEMATIC NAME: 1-[2-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-3-yl]nonan-1-one
MOLECULAR FORMULA: C19H26F3NOS
MOLECULAR WEIGHT: 373.47605
SMILES: CCCCCCCCC(=O)N1CCSC1C2=CC(=CC=C2)C(F)(F)F
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Product OPENEYE NAME: [2-(2,3-dichlorophenyl)thiazolidin-3-yl]-(4-ethylphenyl)methanone
CAS Name: [2-(2,3-dichlorophenyl)-3-thiazolidinyl]-(4-ethylphenyl)methanone
IUPAC NAME: [2-(2,3-dichlorophenyl)-1,3-thiazolidin-3-yl]-(4-ethylphenyl)methanone
SYSTEMATIC NAME: [2-[2,3-bis(chloranyl)phenyl]-1,3-thiazolidin-3-yl]-(4-ethylphenyl)methanone
MOLECULAR FORMULA: C18H17Cl2NOS
MOLECULAR WEIGHT: 366.30468
SMILES: CCC1=CC=C(C=C1)C(=O)N2CCSC2C3=C(C(=CC=C3)Cl)Cl
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Product OPENEYE NAME: 2-(4-benzyloxy-3-methoxy-phenyl)-N-(3,4-difluorophenyl)thiazolidine-3-carboxamide
CAS Name: N-(3,4-difluorophenyl)-2-(3-methoxy-4-phenylmethoxyphenyl)-3-thiazolidinecarboxamide
IUPAC NAME: N-(3,4-difluorophenyl)-2-(3-methoxy-4-phenylmethoxyphenyl)-1,3-thiazolidine-3-carboxamide
SYSTEMATIC NAME: N-[3,4-bis(fluoranyl)phenyl]-2-(3-methoxy-4-phenylmethoxy-phenyl)-1,3-thiazolidine-3-carboxamide
MOLECULAR FORMULA: C24H22F2N2O3S
MOLECULAR WEIGHT: 456.504886
SMILES: COC1=C(C=CC(=C1)C2N(CCS2)C(=O)NC3=CC(=C(C=C3)F)F)OCC4=CC=CC=C4
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Product OPENEYE NAME: 2-(2,4-dimethoxyphenyl)-N-(4-ethylphenyl)thiazolidine-3-carboxamide
CAS Name: 2-(2,4-dimethoxyphenyl)-N-(4-ethylphenyl)-3-thiazolidinecarboxamide
IUPAC NAME: 2-(2,4-dimethoxyphenyl)-N-(4-ethylphenyl)-1,3-thiazolidine-3-carboxamide
SYSTEMATIC NAME: 2-(2,4-dimethoxyphenyl)-N-(4-ethylphenyl)-1,3-thiazolidine-3-carboxamide
MOLECULAR FORMULA: C20H24N2O3S
MOLECULAR WEIGHT: 372.48116
SMILES: CCC1=CC=C(C=C1)NC(=O)N2CCSC2C3=C(C=C(C=C3)OC)OC
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Product OPENEYE NAME: N-(1-benzyl-4-piperidyl)-3-imidazo[1,2-a]pyridin-3-yl-3-(o-tolyl)propanamide
CAS Name: 3-(3-imidazo[1,2-a]pyridinyl)-3-(2-methylphenyl)-N-[1-(phenylmethyl)-4-piperidinyl]propanamide
IUPAC NAME: N-(1-benzylpiperidin-4-yl)-3-imidazo[1,2-a]pyridin-3-yl-3-(2-methylphenyl)propanamide
SYSTEMATIC NAME: 3-imidazo[1,2-a]pyridin-3-yl-3-(2-methylphenyl)-N-[1-(phenylmethyl)piperidin-4-yl]propanamide
MOLECULAR FORMULA: C29H32N4O
MOLECULAR WEIGHT: 452.59058
SMILES: CC1=CC=CC=C1C(CC(=O)NC2CCN(CC2)CC3=CC=CC=C3)C4=CN=C5N4C=CC=C5
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Product OPENEYE NAME: N-[3-[2-(2,4-dichlorophenyl)ethylamino]-3-oxo-propyl]-N-isobutyl-5-methyl-pyrazine-2-carboxamide
CAS Name: N-[3-[2-(2,4-dichlorophenyl)ethylamino]-3-oxopropyl]-5-methyl-N-(2-methylpropyl)-2-pyrazinecarboxamide
IUPAC NAME: N-[3-[2-(2,4-dichlorophenyl)ethylamino]-3-oxopropyl]-5-methyl-N-(2-methylpropyl)pyrazine-2-carboxamide
SYSTEMATIC NAME: N-[3-[2-(2,4-dichlorophenyl)ethylamino]-3-oxidanylidene-propyl]-5-methyl-N-(2-methylpropyl)pyrazine-2-carboxamide
MOLECULAR FORMULA: C21H26Cl2N4O2
MOLECULAR WEIGHT: 437.36274
SMILES: CC1=NC=C(N=C1)C(=O)N(CCC(=O)NCCC2=C(C=C(C=C2)Cl)Cl)CC(C)C
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Product OPENEYE NAME: N-[3-[[4-(diethylamino)-1-methyl-butyl]amino]-3-oxo-propyl]-N-isobutyl-pyrazine-2-carboxamide
CAS Name: N-[3-[5-(diethylamino)pentan-2-ylamino]-3-oxopropyl]-N-(2-methylpropyl)-2-pyrazinecarboxamide
IUPAC NAME: N-[3-[5-(diethylamino)pentan-2-ylamino]-3-oxopropyl]-N-(2-methylpropyl)pyrazine-2-carboxamide
SYSTEMATIC NAME: N-[3-[5-(diethylamino)pentan-2-ylamino]-3-oxidanylidene-propyl]-N-(2-methylpropyl)pyrazine-2-carboxamide
MOLECULAR FORMULA: C21H37N5O2
MOLECULAR WEIGHT: 391.55078
SMILES: CCN(CC)CCCC(C)NC(=O)CCN(CC(C)C)C(=O)C1=NC=CN=C1
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Product OPENEYE NAME: 3-(6-chloroimidazo[1,2-a]pyridin-3-yl)-3-(2-fluorophenyl)-1-[4-(4-methoxyphenyl)piperazin-1-yl]propan-1-one
CAS Name: 3-(6-chloro-3-imidazo[1,2-a]pyridinyl)-3-(2-fluorophenyl)-1-[4-(4-methoxyphenyl)-1-piperazinyl]-1-propanone
IUPAC NAME: 3-(6-chloroimidazo[1,2-a]pyridin-3-yl)-3-(2-fluorophenyl)-1-[4-(4-methoxyphenyl)piperazin-1-yl]propan-1-one
SYSTEMATIC NAME: 3-(6-chloranylimidazo[1,2-a]pyridin-3-yl)-3-(2-fluorophenyl)-1-[4-(4-methoxyphenyl)piperazin-1-yl]propan-1-one
MOLECULAR FORMULA: C27H26ClFN4O2
MOLECULAR WEIGHT: 492.972343
SMILES: COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CC(C3=CC=CC=C3F)C4=CN=C5N4C=C(C=C5)Cl
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Product OPENEYE NAME: 3-(8-benzyloxyimidazo[1,2-a]pyridin-3-yl)-3-(3,5-dimethoxyphenyl)-1-[4-(2-methoxyphenyl)piperazin-1-yl]propan-1-one
CAS Name: 3-(3,5-dimethoxyphenyl)-1-[4-(2-methoxyphenyl)-1-piperazinyl]-3-(8-phenylmethoxy-3-imidazo[1,2-a]pyridinyl)-1-propanone
IUPAC NAME: 3-(3,5-dimethoxyphenyl)-1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(8-phenylmethoxyimidazo[1,2-a]pyridin-3-yl)propan-1-one
SYSTEMATIC NAME: 3-(3,5-dimethoxyphenyl)-1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(8-phenylmethoxyimidazo[1,2-a]pyridin-3-yl)propan-1-one
MOLECULAR FORMULA: C36H38N4O5
MOLECULAR WEIGHT: 606.71072
SMILES: COC1=CC=CC=C1N2CCN(CC2)C(=O)CC(C3=CC(=CC(=C3)OC)OC)C4=CN=C5N4C=CC=C5OCC6=CC=CC=C6
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Product OPENEYE NAME: 2,2-dimethyl-N-[4-[5-(2-methylpropanoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]propanamide
CAS Name: 2,2-dimethyl-N-[4-[5-(2-methyl-1-oxopropyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]propanamide
IUPAC NAME: 2,2-dimethyl-N-[4-[5-(2-methylpropanoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]propanamide
SYSTEMATIC NAME: 2,2-dimethyl-N-[4-[5-(2-methylpropanoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]propanamide
MOLECULAR FORMULA: C22H28N2O3
MOLECULAR WEIGHT: 368.46932
SMILES: CC(C)C(=O)N1CCC2=C(C1)C=C(O2)C3=CC=C(C=C3)NC(=O)C(C)(C)C
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Product OPENEYE NAME: N-benzyl-2-[(2-chloroacetyl)-(2-methoxyethyl)amino]-N-[(6-methyl-4-oxo-chromen-3-yl)methyl]acetamide
CAS Name: 2-[(2-chloro-1-oxoethyl)-(2-methoxyethyl)amino]-N-[(6-methyl-4-oxo-1-benzopyran-3-yl)methyl]-N-(phenylmethyl)acetamide
IUPAC NAME: N-benzyl-2-[(2-chloroacetyl)-(2-methoxyethyl)amino]-N-[(6-methyl-4-oxochromen-3-yl)methyl]acetamide
SYSTEMATIC NAME: 2-[2-chloranylethanoyl(2-methoxyethyl)amino]-N-[(6-methyl-4-oxidanylidene-chromen-3-yl)methyl]-N-(phenylmethyl)ethanamide
MOLECULAR FORMULA: C25H27ClN2O5
MOLECULAR WEIGHT: 470.94528
SMILES: CC1=CC2=C(C=C1)OC=C(C2=O)CN(CC3=CC=CC=C3)C(=O)CN(CCOC)C(=O)CCl
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Product OPENEYE NAME: 4-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxo-ethyl]-6-methyl-1,4-benzoxazin-3-one
CAS Name: 4-[2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-2-oxoethyl]-6-methyl-1,4-benzoxazin-3-one
IUPAC NAME: 4-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxoethyl]-6-methyl-1,4-benzoxazin-3-one
SYSTEMATIC NAME: 4-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-6-methyl-1,4-benzoxazin-3-one
MOLECULAR FORMULA: C23H25N3O5
MOLECULAR WEIGHT: 423.4617
SMILES: CC1=CC2=C(C=C1)OCC(=O)N2CC(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5
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Product OPENEYE NAME: 5-[[6-(1,1-dimethylpropyl)-3-oxo-1,4-benzoxazin-4-yl]methyl]-N-(2-furylmethyl)furan-2-carboxamide
CAS Name: N-(2-furanylmethyl)-5-[[6-(2-methylbutan-2-yl)-3-oxo-1,4-benzoxazin-4-yl]methyl]-2-furancarboxamide
IUPAC NAME: N-(furan-2-ylmethyl)-5-[[6-(2-methylbutan-2-yl)-3-oxo-1,4-benzoxazin-4-yl]methyl]furan-2-carboxamide
SYSTEMATIC NAME: N-(furan-2-ylmethyl)-5-[[6-(2-methylbutan-2-yl)-3-oxidanylidene-1,4-benzoxazin-4-yl]methyl]furan-2-carboxamide
MOLECULAR FORMULA: C24H26N2O5
MOLECULAR WEIGHT: 422.47364
SMILES: CCC(C)(C)C1=CC2=C(C=C1)OCC(=O)N2CC3=CC=C(O3)C(=O)NCC4=CC=CO4
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Product OPENEYE NAME: N-[2-[1-(4-isopropylphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]-2-oxo-ethyl]-N-propyl-quinoline-8-sulfonamide
CAS Name: N-[2-oxo-2-[1-(4-propan-2-ylphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]ethyl]-N-propyl-8-quinolinesulfonamide
IUPAC NAME: N-[2-oxo-2-[1-(4-propan-2-ylphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]ethyl]-N-propylquinoline-8-sulfonamide
SYSTEMATIC NAME: N-[2-oxidanylidene-2-[1-(4-propan-2-ylphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]ethyl]-N-propyl-quinoline-8-sulfonamide
MOLECULAR FORMULA: C30H34N4O3S
MOLECULAR WEIGHT: 530.68096
SMILES: CCCN(CC(=O)N1CCN2C=CC=C2C1C3=CC=C(C=C3)C(C)C)S(=O)(=O)C4=CC=CC5=C4N=CC=C5
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