Sunday, December 30, 2012

All Chemical Compounds Information




Product OPENEYE NAME: N-[2-[3-(2-furyl)-2-propanoyl-3,4-dihydropyrazol-5-yl]phenyl]-4-methyl-benzenesulfonamide
CAS Name: N-[2-[3-(2-furanyl)-2-(1-oxopropyl)-3,4-dihydropyrazol-5-yl]phenyl]-4-methylbenzenesulfonamide
IUPAC NAME: N-[2-[3-(furan-2-yl)-2-propanoyl-3,4-dihydropyrazol-5-yl]phenyl]-4-methylbenzenesulfonamide
SYSTEMATIC NAME: N-[2-[3-(furan-2-yl)-2-propanoyl-3,4-dihydropyrazol-5-yl]phenyl]-4-methyl-benzenesulfonamide
MOLECULAR FORMULA: C23H23N3O4S
MOLECULAR WEIGHT: 437.51142
SMILES: CCC(=O)N1C(CC(=N1)C2=CC=CC=C2NS(=O)(=O)C3=CC=C(C=C3)C)C4=CC=CO4
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Product OPENEYE NAME: 4-[3-(2-furyl)-5-[2-(p-tolylsulfonylamino)phenyl]-3,4-dihydropyrazol-2-yl]-4-oxo-butanoic acid
CAS Name: 4-[3-(2-furanyl)-5-[2-[(4-methylphenyl)sulfonylamino]phenyl]-3,4-dihydropyrazol-2-yl]-4-oxobutanoic acid
IUPAC NAME: 4-[3-(furan-2-yl)-5-[2-[(4-methylphenyl)sulfonylamino]phenyl]-3,4-dihydropyrazol-2-yl]-4-oxobutanoic acid
SYSTEMATIC NAME: 4-[3-(furan-2-yl)-5-[2-[(4-methylphenyl)sulfonylamino]phenyl]-3,4-dihydropyrazol-2-yl]-4-oxidanylidene-butanoic acid
MOLECULAR FORMULA: C24H23N3O6S
MOLECULAR WEIGHT: 481.52092
SMILES: CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C3=NN(C(C3)C4=CC=CO4)C(=O)CCC(=O)O
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Product OPENEYE NAME: 5-[2-(benzenesulfonyl)-5-(p-tolyl)-3,4-dihydropyrazol-3-yl]quinoxaline
CAS Name: 5-[2-(benzenesulfonyl)-5-(4-methylphenyl)-3,4-dihydropyrazol-3-yl]quinoxaline
IUPAC NAME: 5-[2-(benzenesulfonyl)-5-(4-methylphenyl)-3,4-dihydropyrazol-3-yl]quinoxaline
SYSTEMATIC NAME: 5-[5-(4-methylphenyl)-2-(phenylsulfonyl)-3,4-dihydropyrazol-3-yl]quinoxaline
MOLECULAR FORMULA: C24H20N4O2S
MOLECULAR WEIGHT: 428.5062
SMILES: CC1=CC=C(C=C1)C2=NN(C(C2)C3=C4C(=CC=C3)N=CC=N4)S(=O)(=O)C5=CC=CC=C5
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Product OPENEYE NAME: 1-[6-chloro-2-(4-methylpiperazin-1-yl)-4-phenyl-3-quinolyl]ethanone
CAS Name: 1-[6-chloro-2-(4-methyl-1-piperazinyl)-4-phenyl-3-quinolinyl]ethanone
IUPAC NAME: 1-[6-chloro-2-(4-methylpiperazin-1-yl)-4-phenylquinolin-3-yl]ethanone
SYSTEMATIC NAME: 1-[6-chloranyl-2-(4-methylpiperazin-1-yl)-4-phenyl-quinolin-3-yl]ethanone
MOLECULAR FORMULA: C22H22ClN3O
MOLECULAR WEIGHT: 379.88258
SMILES: CC(=O)C1=C(N=C2C=CC(=CC2=C1C3=CC=CC=C3)Cl)N4CCN(CC4)C
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Product OPENEYE NAME: N-[3-[3-(2-furyl)-2-propanoyl-3,4-dihydropyrazol-5-yl]phenyl]benzenesulfonamide
CAS Name: N-[3-[3-(2-furanyl)-2-(1-oxopropyl)-3,4-dihydropyrazol-5-yl]phenyl]benzenesulfonamide
IUPAC NAME: N-[3-[3-(furan-2-yl)-2-propanoyl-3,4-dihydropyrazol-5-yl]phenyl]benzenesulfonamide
SYSTEMATIC NAME: N-[3-[3-(furan-2-yl)-2-propanoyl-3,4-dihydropyrazol-5-yl]phenyl]benzenesulfonamide
MOLECULAR FORMULA: C22H21N3O4S
MOLECULAR WEIGHT: 423.48484
SMILES: CCC(=O)N1C(CC(=N1)C2=CC(=CC=C2)NS(=O)(=O)C3=CC=CC=C3)C4=CC=CO4
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Product OPENEYE NAME: (E)-N-[1-methyl-2-(2-oxopyrrolidin-1-yl)ethyl]-3-(m-tolyl)prop-2-enamide
CAS Name: (E)-3-(3-methylphenyl)-N-[1-(2-oxo-1-pyrrolidinyl)propan-2-yl]-2-propenamide
IUPAC NAME: (E)-3-(3-methylphenyl)-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]prop-2-enamide
SYSTEMATIC NAME: (E)-3-(3-methylphenyl)-N-[1-(2-oxidanylidenepyrrolidin-1-yl)propan-2-yl]prop-2-enamide
MOLECULAR FORMULA: C17H22N2O2
MOLECULAR WEIGHT: 286.36878
SMILES: CC1=CC=CC(=C1)/C=C/C(=O)NC(C)CN2CCCC2=O
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Product OPENEYE NAME: (E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)propyl]prop-2-enamide
CAS Name: (E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)propyl]-2-propenamide
IUPAC NAME: (E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)propyl]prop-2-enamide
SYSTEMATIC NAME: (E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)propyl]prop-2-enamide
MOLECULAR FORMULA: C22H23NO5
MOLECULAR WEIGHT: 381.42172
SMILES: CCC(C1=CC2=C(C=C1)OCCO2)NC(=O)/C=C/C3=CC4=C(C=C3)OCCO4
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Product OPENEYE NAME: N-[(1S)-1-[[4-(4-acetamidophenyl)thiazol-2-yl]carbamoyl]-2-methyl-propyl]-4-methoxy-benzamide
CAS Name: N-[(2S)-1-[[4-(4-acetamidophenyl)-2-thiazolyl]amino]-3-methyl-1-oxobutan-2-yl]-4-methoxybenzamide
IUPAC NAME: N-[(2S)-1-[[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]amino]-3-methyl-1-oxobutan-2-yl]-4-methoxybenzamide
SYSTEMATIC NAME: N-[(2S)-1-[[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]-4-methoxy-benzamide
MOLECULAR FORMULA: C24H26N4O4S
MOLECULAR WEIGHT: 466.55264
SMILES: CC(C)[C@@H](C(=O)NC1=NC(=CS1)C2=CC=C(C=C2)NC(=O)C)NC(=O)C3=CC=C(C=C3)OC
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Product OPENEYE NAME: (Z)-N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)prop-2-enamide
CAS Name: (Z)-N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-2-cyano-3-(2,5-dimethyl-1-propyl-3-pyrrolyl)-2-propenamide
IUPAC NAME: (Z)-N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-2-cyano-3-(2,5-dimethyl-1-propylpyrrol-3-yl)prop-2-enamide
SYSTEMATIC NAME: (Z)-N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)prop-2-enamide
MOLECULAR FORMULA: C24H29N5OS
MOLECULAR WEIGHT: 435.58496
SMILES: CCCN1C(=CC(=C1C)/C=C(/C#N)\C(=O)N[C@@H](CCSC)C2=NC3=CC=CC=C3N2)C
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Product OPENEYE NAME: N-[(1S)-1-benzyl-2-oxo-2-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylamino)ethyl]furan-2-carboxamide
CAS Name: N-[(2S)-1-oxo-3-phenyl-1-(5-spiro[1,3-benzodioxole-2,1'-cyclopentane]ylamino)propan-2-yl]-2-furancarboxamide
IUPAC NAME: N-[(2S)-1-oxo-3-phenyl-1-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylamino)propan-2-yl]furan-2-carboxamide
SYSTEMATIC NAME: N-[(2S)-1-oxidanylidene-3-phenyl-1-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylamino)propan-2-yl]furan-2-carboxamide
MOLECULAR FORMULA: C25H24N2O5
MOLECULAR WEIGHT: 432.46846
SMILES: C1CCC2(C1)OC3=C(O2)C=C(C=C3)NC(=O)[C@H](CC4=CC=CC=C4)NC(=O)C5=CC=CO5
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Product OPENEYE NAME: 2,6-difluoro-N-[(1S)-1-[(4-imidazo[2,1-b]thiazol-6-ylphenyl)carbamoyl]-2-methyl-propyl]benzamide
CAS Name: 2,6-difluoro-N-[(2S)-1-[4-(6-imidazo[2,1-b]thiazolyl)anilino]-3-methyl-1-oxobutan-2-yl]benzamide
IUPAC NAME: 2,6-difluoro-N-[(2S)-1-(4-imidazo[2,1-b][1,3]thiazol-6-ylanilino)-3-methyl-1-oxobutan-2-yl]benzamide
SYSTEMATIC NAME: 2,6-bis(fluoranyl)-N-[(2S)-1-[(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)amino]-3-methyl-1-oxidanylidene-butan-2-yl]benzamide
MOLECULAR FORMULA: C23H20F2N4O2S
MOLECULAR WEIGHT: 454.492306
SMILES: CC(C)[C@@H](C(=O)NC1=CC=C(C=C1)C2=CN3C=CSC3=N2)NC(=O)C4=C(C=CC=C4F)F
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Product OPENEYE NAME: (2S)-N-[1-(3-chlorophenyl)ethyl]-3-methyl-2-(p-tolylsulfonylamino)butanamide
CAS Name: (2S)-N-[1-(3-chlorophenyl)ethyl]-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanamide
IUPAC NAME: (2S)-N-[1-(3-chlorophenyl)ethyl]-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanamide
SYSTEMATIC NAME: (2S)-N-[1-(3-chlorophenyl)ethyl]-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanamide
MOLECULAR FORMULA: C20H25ClN2O3S
MOLECULAR WEIGHT: 408.9421
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](C(C)C)C(=O)NC(C)C2=CC(=CC=C2)Cl
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Product OPENEYE NAME: 3-(diethylsulfamoyl)-N-[(1S)-2-methyl-1-(1-phenylethylcarbamoyl)propyl]benzamide
CAS Name: 3-(diethylsulfamoyl)-N-[(2S)-3-methyl-1-oxo-1-(1-phenylethylamino)butan-2-yl]benzamide
IUPAC NAME: 3-(diethylsulfamoyl)-N-[(2S)-3-methyl-1-oxo-1-(1-phenylethylamino)butan-2-yl]benzamide
SYSTEMATIC NAME: 3-(diethylsulfamoyl)-N-[(2S)-3-methyl-1-oxidanylidene-1-(1-phenylethylamino)butan-2-yl]benzamide
MOLECULAR FORMULA: C24H33N3O4S
MOLECULAR WEIGHT: 459.60152
SMILES: CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)N[C@@H](C(C)C)C(=O)NC(C)C2=CC=CC=C2
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Product OPENEYE NAME: 4-methoxy-N-[(1S)-2-methyl-1-(1-phenylethylcarbamoyl)propyl]benzamide
CAS Name: 4-methoxy-N-[(2S)-3-methyl-1-oxo-1-(1-phenylethylamino)butan-2-yl]benzamide
IUPAC NAME: 4-methoxy-N-[(2S)-3-methyl-1-oxo-1-(1-phenylethylamino)butan-2-yl]benzamide
SYSTEMATIC NAME: 4-methoxy-N-[(2S)-3-methyl-1-oxidanylidene-1-(1-phenylethylamino)butan-2-yl]benzamide
MOLECULAR FORMULA: C21H26N2O3
MOLECULAR WEIGHT: 354.44274
SMILES: CC(C)[C@@H](C(=O)NC(C)C1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)OC
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Product OPENEYE NAME: N-[(1S)-1-(2,6-dimethylmorpholine-4-carbonyl)-2-methyl-propyl]-4-methoxy-benzenesulfonamide
CAS Name: N-[(2S)-1-(2,6-dimethyl-4-morpholinyl)-3-methyl-1-oxobutan-2-yl]-4-methoxybenzenesulfonamide
IUPAC NAME: N-[(2S)-1-(2,6-dimethylmorpholin-4-yl)-3-methyl-1-oxobutan-2-yl]-4-methoxybenzenesulfonamide
SYSTEMATIC NAME: N-[(2S)-1-(2,6-dimethylmorpholin-4-yl)-3-methyl-1-oxidanylidene-butan-2-yl]-4-methoxy-benzenesulfonamide
MOLECULAR FORMULA: C18H28N2O5S
MOLECULAR WEIGHT: 384.49032
SMILES: CC1CN(CC(O1)C)C(=O)[C@H](C(C)C)NS(=O)(=O)C2=CC=C(C=C2)OC
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