Saturday, October 27, 2012

All Chemical Compounds Information




Product OPENEYE NAME: methyl 2-[5-methyl-2-[[5-methyl-2-(trifluoromethyl)furan-3-carbonyl]amino]thiazol-4-yl]acetate
CAS Name: 2-[5-methyl-2-[[[5-methyl-2-(trifluoromethyl)-3-furanyl]-oxomethyl]amino]-4-thiazolyl]acetic acid methyl ester
IUPAC NAME: methyl 2-[5-methyl-2-[[5-methyl-2-(trifluoromethyl)furan-3-carbonyl]amino]-1,3-thiazol-4-yl]acetate
SYSTEMATIC NAME: methyl 2-[5-methyl-2-[[5-methyl-2-(trifluoromethyl)furan-3-yl]carbonylamino]-1,3-thiazol-4-yl]ethanoate
MOLECULAR FORMULA: C14H13F3N2O4S
MOLECULAR WEIGHT: 362.32423
SMILES: CC1=CC(=C(O1)C(F)(F)F)C(=O)NC2=NC(=C(S2)C)CC(=O)OC
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Product OPENEYE NAME: methyl 2-[5-methyl-2-(thiophene-2-carbonylamino)thiazol-4-yl]acetate
CAS Name: 2-[5-methyl-2-[[oxo(thiophen-2-yl)methyl]amino]-4-thiazolyl]acetic acid methyl ester
IUPAC NAME: methyl 2-[5-methyl-2-(thiophene-2-carbonylamino)-1,3-thiazol-4-yl]acetate
SYSTEMATIC NAME: methyl 2-[5-methyl-2-(thiophen-2-ylcarbonylamino)-1,3-thiazol-4-yl]ethanoate
MOLECULAR FORMULA: C12H12N2O3S2
MOLECULAR WEIGHT: 296.36528
SMILES: CC1=C(N=C(S1)NC(=O)C2=CC=CS2)CC(=O)OC
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Product OPENEYE NAME: methyl 2-[5-methyl-2-[(5-methyl-2-phenyl-oxazole-4-carbonyl)amino]thiazol-4-yl]acetate
CAS Name: 2-[5-methyl-2-[[(5-methyl-2-phenyl-4-oxazolyl)-oxomethyl]amino]-4-thiazolyl]acetic acid methyl ester
IUPAC NAME: methyl 2-[5-methyl-2-[(5-methyl-2-phenyl-1,3-oxazole-4-carbonyl)amino]-1,3-thiazol-4-yl]acetate
SYSTEMATIC NAME: methyl 2-[5-methyl-2-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)carbonylamino]-1,3-thiazol-4-yl]ethanoate
MOLECULAR FORMULA: C18H17N3O4S
MOLECULAR WEIGHT: 371.41028
SMILES: CC1=C(N=C(O1)C2=CC=CC=C2)C(=O)NC3=NC(=C(S3)C)CC(=O)OC
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Product OPENEYE NAME: N-[2-(4-methoxyphenoxy)-5-(trifluoromethyl)phenyl]-5-methyl-2-phenyl-oxazole-4-carboxamide
CAS Name: N-[2-(4-methoxyphenoxy)-5-(trifluoromethyl)phenyl]-5-methyl-2-phenyl-4-oxazolecarboxamide
IUPAC NAME: N-[2-(4-methoxyphenoxy)-5-(trifluoromethyl)phenyl]-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide
SYSTEMATIC NAME: N-[2-(4-methoxyphenoxy)-5-(trifluoromethyl)phenyl]-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide
MOLECULAR FORMULA: C25H19F3N2O4
MOLECULAR WEIGHT: 468.42457
SMILES: CC1=C(N=C(O1)C2=CC=CC=C2)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)OC4=CC=C(C=C4)OC
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Product OPENEYE NAME: N-[2-(4-methoxyphenoxy)-5-(trifluoromethyl)phenyl]thiophene-2-sulfonamide
CAS Name: N-[2-(4-methoxyphenoxy)-5-(trifluoromethyl)phenyl]-2-thiophenesulfonamide
IUPAC NAME: N-[2-(4-methoxyphenoxy)-5-(trifluoromethyl)phenyl]thiophene-2-sulfonamide
SYSTEMATIC NAME: N-[2-(4-methoxyphenoxy)-5-(trifluoromethyl)phenyl]thiophene-2-sulfonamide
MOLECULAR FORMULA: C18H14F3NO4S2
MOLECULAR WEIGHT: 429.43327
SMILES: COC1=CC=C(C=C1)OC2=C(C=C(C=C2)C(F)(F)F)NS(=O)(=O)C3=CC=CS3
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Product OPENEYE NAME: N-[2-(4-methoxyphenoxy)-5-(trifluoromethyl)phenyl]-2,1,3-benzoxadiazole-4-sulfonamide
CAS Name: N-[2-(4-methoxyphenoxy)-5-(trifluoromethyl)phenyl]-2,1,3-benzoxadiazole-4-sulfonamide
IUPAC NAME: N-[2-(4-methoxyphenoxy)-5-(trifluoromethyl)phenyl]-2,1,3-benzoxadiazole-4-sulfonamide
SYSTEMATIC NAME: N-[2-(4-methoxyphenoxy)-5-(trifluoromethyl)phenyl]-2,1,3-benzoxadiazole-4-sulfonamide
MOLECULAR FORMULA: C20H14F3N3O5S
MOLECULAR WEIGHT: 465.40247
SMILES: COC1=CC=C(C=C1)OC2=C(C=C(C=C2)C(F)(F)F)NS(=O)(=O)C3=CC=CC4=NON=C43
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Product OPENEYE NAME: N-[2-(4-methoxyphenoxy)-5-(trifluoromethyl)phenyl]-3,4-dimethyl-benzamide
CAS Name: N-[2-(4-methoxyphenoxy)-5-(trifluoromethyl)phenyl]-3,4-dimethylbenzamide
IUPAC NAME: N-[2-(4-methoxyphenoxy)-5-(trifluoromethyl)phenyl]-3,4-dimethylbenzamide
SYSTEMATIC NAME: N-[2-(4-methoxyphenoxy)-5-(trifluoromethyl)phenyl]-3,4-dimethyl-benzamide
MOLECULAR FORMULA: C23H20F3NO3
MOLECULAR WEIGHT: 415.40501
SMILES: CC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(F)(F)F)OC3=CC=C(C=C3)OC)C
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Product OPENEYE NAME: 2-[[5-(4-methoxyphenoxy)-2-(trifluoromethyl)phenyl]carbamoyl]cyclobutanecarboxylic acid
CAS Name: 2-[[5-(4-methoxyphenoxy)-2-(trifluoromethyl)anilino]-oxomethyl]-1-cyclobutanecarboxylic acid
IUPAC NAME: 2-[[5-(4-methoxyphenoxy)-2-(trifluoromethyl)phenyl]carbamoyl]cyclobutane-1-carboxylic acid
SYSTEMATIC NAME: 2-[[5-(4-methoxyphenoxy)-2-(trifluoromethyl)phenyl]carbamoyl]cyclobutane-1-carboxylic acid
MOLECULAR FORMULA: C20H18F3NO5
MOLECULAR WEIGHT: 409.35583
SMILES: COC1=CC=C(C=C1)OC2=CC(=C(C=C2)C(F)(F)F)NC(=O)C3CCC3C(=O)O
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Product OPENEYE NAME: 2-[[4-(5-chloro-2-thienyl)thiazol-2-yl]-methyl-carbamoyl]cyclobutanecarboxylic acid
CAS Name: 2-[[[4-(5-chloro-2-thiophenyl)-2-thiazolyl]-methylamino]-oxomethyl]-1-cyclobutanecarboxylic acid
IUPAC NAME: 2-[[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-methylcarbamoyl]cyclobutane-1-carboxylic acid
SYSTEMATIC NAME: 2-[[4-(5-chloranylthiophen-2-yl)-1,3-thiazol-2-yl]-methyl-carbamoyl]cyclobutane-1-carboxylic acid
MOLECULAR FORMULA: C14H13ClN2O3S2
MOLECULAR WEIGHT: 356.84762
SMILES: CN(C1=NC(=CS1)C2=CC=C(S2)Cl)C(=O)C3CCC3C(=O)O
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Product OPENEYE NAME: 2-[[4-(5-chloro-2-thienyl)thiazol-2-yl]carbamoyl]cyclobutanecarboxylic acid
CAS Name: 2-[[[4-(5-chloro-2-thiophenyl)-2-thiazolyl]amino]-oxomethyl]-1-cyclobutanecarboxylic acid
IUPAC NAME: 2-[[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]carbamoyl]cyclobutane-1-carboxylic acid
SYSTEMATIC NAME: 2-[[4-(5-chloranylthiophen-2-yl)-1,3-thiazol-2-yl]carbamoyl]cyclobutane-1-carboxylic acid
MOLECULAR FORMULA: C13H11ClN2O3S2
MOLECULAR WEIGHT: 342.82104
SMILES: C1CC(C1C(=O)NC2=NC(=CS2)C3=CC=C(S3)Cl)C(=O)O
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Product OPENEYE NAME: 2-[4-[5-(trifluoromethyl)-2-pyridyl]piperazine-1-carbonyl]cyclobutanecarboxylic acid
CAS Name: 2-[oxo-[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]methyl]-1-cyclobutanecarboxylic acid
IUPAC NAME: 2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazine-1-carbonyl]cyclobutane-1-carboxylic acid
SYSTEMATIC NAME: 2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]carbonylcyclobutane-1-carboxylic acid
MOLECULAR FORMULA: C16H18F3N3O3
MOLECULAR WEIGHT: 357.32763
SMILES: C1CC(C1C(=O)N2CCN(CC2)C3=NC=C(C=C3)C(F)(F)F)C(=O)O
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Product OPENEYE NAME: 2-[4-(5-nitro-2-pyridyl)piperazine-1-carbonyl]cyclobutanecarboxylic acid
CAS Name: 2-[[4-(5-nitro-2-pyridinyl)-1-piperazinyl]-oxomethyl]-1-cyclobutanecarboxylic acid
IUPAC NAME: 2-[4-(5-nitropyridin-2-yl)piperazine-1-carbonyl]cyclobutane-1-carboxylic acid
SYSTEMATIC NAME: 2-[4-(5-nitropyridin-2-yl)piperazin-1-yl]carbonylcyclobutane-1-carboxylic acid
MOLECULAR FORMULA: C15H18N4O5
MOLECULAR WEIGHT: 334.32722
SMILES: C1CC(C1C(=O)N2CCN(CC2)C3=NC=C(C=C3)[N+](=O)[O-])C(=O)O
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Product OPENEYE NAME: 2-[[4-(2-methoxy-2-oxo-ethyl)-5-methyl-thiazol-2-yl]carbamoyl]cyclobutanecarboxylic acid
CAS Name: 2-[[[4-(2-methoxy-2-oxoethyl)-5-methyl-2-thiazolyl]amino]-oxomethyl]-1-cyclobutanecarboxylic acid
IUPAC NAME: 2-[[4-(2-methoxy-2-oxoethyl)-5-methyl-1,3-thiazol-2-yl]carbamoyl]cyclobutane-1-carboxylic acid
SYSTEMATIC NAME: 2-[[4-(2-methoxy-2-oxidanylidene-ethyl)-5-methyl-1,3-thiazol-2-yl]carbamoyl]cyclobutane-1-carboxylic acid
MOLECULAR FORMULA: C13H16N2O5S
MOLECULAR WEIGHT: 312.34154
SMILES: CC1=C(N=C(S1)NC(=O)C2CCC2C(=O)O)CC(=O)OC
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Product OPENEYE NAME: 2-[4-(2-methyl-4-quinolyl)piperazine-1-carbonyl]cyclobutanecarboxylic acid
CAS Name: 2-[[4-(2-methyl-4-quinolinyl)-1-piperazinyl]-oxomethyl]-1-cyclobutanecarboxylic acid
IUPAC NAME: 2-[4-(2-methylquinolin-4-yl)piperazine-1-carbonyl]cyclobutane-1-carboxylic acid
SYSTEMATIC NAME: 2-[4-(2-methylquinolin-4-yl)piperazin-1-yl]carbonylcyclobutane-1-carboxylic acid
MOLECULAR FORMULA: C20H23N3O3
MOLECULAR WEIGHT: 353.41492
SMILES: CC1=NC2=CC=CC=C2C(=C1)N3CCN(CC3)C(=O)C4CCC4C(=O)O
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Product OPENEYE NAME: cyclohexyl-[4-(4-nitro-2-pyrrol-1-yl-phenyl)piperazin-1-yl]methanone
CAS Name: cyclohexyl-[4-[4-nitro-2-(1-pyrrolyl)phenyl]-1-piperazinyl]methanone
IUPAC NAME: cyclohexyl-[4-(4-nitro-2-pyrrol-1-ylphenyl)piperazin-1-yl]methanone
SYSTEMATIC NAME: cyclohexyl-[4-(4-nitro-2-pyrrol-1-yl-phenyl)piperazin-1-yl]methanone
MOLECULAR FORMULA: C21H26N4O3
MOLECULAR WEIGHT: 382.45614
SMILES: C1CCC(CC1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])N4C=CC=C4
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Product OPENEYE NAME: [4-(4-nitro-2-pyrrol-1-yl-phenyl)piperazin-1-yl]-phenyl-methanone
CAS Name: [4-[4-nitro-2-(1-pyrrolyl)phenyl]-1-piperazinyl]-phenylmethanone
IUPAC NAME: [4-(4-nitro-2-pyrrol-1-ylphenyl)piperazin-1-yl]-phenylmethanone
SYSTEMATIC NAME: [4-(4-nitro-2-pyrrol-1-yl-phenyl)piperazin-1-yl]-phenyl-methanone
MOLECULAR FORMULA: C21H20N4O3
MOLECULAR WEIGHT: 376.4085
SMILES: C1CN(CCN1C2=C(C=C(C=C2)[N+](=O)[O-])N3C=CC=C3)C(=O)C4=CC=CC=C4
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Product OPENEYE NAME: cyclopropyl-[4-(4-nitro-2-pyrrol-1-yl-phenyl)piperazin-1-yl]methanone
CAS Name: cyclopropyl-[4-[4-nitro-2-(1-pyrrolyl)phenyl]-1-piperazinyl]methanone
IUPAC NAME: cyclopropyl-[4-(4-nitro-2-pyrrol-1-ylphenyl)piperazin-1-yl]methanone
SYSTEMATIC NAME: cyclopropyl-[4-(4-nitro-2-pyrrol-1-yl-phenyl)piperazin-1-yl]methanone
MOLECULAR FORMULA: C18H20N4O3
MOLECULAR WEIGHT: 340.3764
SMILES: C1CC1C(=O)N2CCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])N4C=CC=C4
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Product OPENEYE NAME: [4-(4-nitro-2-pyrrol-1-yl-phenyl)piperazin-1-yl]-[2-(trifluoromethyl)phenyl]methanone
CAS Name: [4-[4-nitro-2-(1-pyrrolyl)phenyl]-1-piperazinyl]-[2-(trifluoromethyl)phenyl]methanone
IUPAC NAME: [4-(4-nitro-2-pyrrol-1-ylphenyl)piperazin-1-yl]-[2-(trifluoromethyl)phenyl]methanone
SYSTEMATIC NAME: [4-(4-nitro-2-pyrrol-1-yl-phenyl)piperazin-1-yl]-[2-(trifluoromethyl)phenyl]methanone
MOLECULAR FORMULA: C22H19F3N4O3
MOLECULAR WEIGHT: 444.40647
SMILES: C1CN(CCN1C2=C(C=C(C=C2)[N+](=O)[O-])N3C=CC=C3)C(=O)C4=CC=CC=C4C(F)(F)F
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Product OPENEYE NAME: (3-chlorophenyl)-[4-(4-nitro-2-pyrrol-1-yl-phenyl)piperazin-1-yl]methanone
CAS Name: (3-chlorophenyl)-[4-[4-nitro-2-(1-pyrrolyl)phenyl]-1-piperazinyl]methanone
IUPAC NAME: (3-chlorophenyl)-[4-(4-nitro-2-pyrrol-1-ylphenyl)piperazin-1-yl]methanone
SYSTEMATIC NAME: (3-chlorophenyl)-[4-(4-nitro-2-pyrrol-1-yl-phenyl)piperazin-1-yl]methanone
MOLECULAR FORMULA: C21H19ClN4O3
MOLECULAR WEIGHT: 410.85356
SMILES: C1CN(CCN1C2=C(C=C(C=C2)[N+](=O)[O-])N3C=CC=C3)C(=O)C4=CC(=CC=C4)Cl
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Product OPENEYE NAME: (2-fluorophenyl)-[4-(4-nitro-2-pyrrol-1-yl-phenyl)piperazin-1-yl]methanone
CAS Name: (2-fluorophenyl)-[4-[4-nitro-2-(1-pyrrolyl)phenyl]-1-piperazinyl]methanone
IUPAC NAME: (2-fluorophenyl)-[4-(4-nitro-2-pyrrol-1-ylphenyl)piperazin-1-yl]methanone
SYSTEMATIC NAME: (2-fluorophenyl)-[4-(4-nitro-2-pyrrol-1-yl-phenyl)piperazin-1-yl]methanone
MOLECULAR FORMULA: C21H19FN4O3
MOLECULAR WEIGHT: 394.398963
SMILES: C1CN(CCN1C2=C(C=C(C=C2)[N+](=O)[O-])N3C=CC=C3)C(=O)C4=CC=CC=C4F
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Product OPENEYE NAME: 2,2-dimethyl-1-[4-(4-nitro-2-pyrrol-1-yl-phenyl)piperazin-1-yl]propan-1-one
CAS Name: 2,2-dimethyl-1-[4-[4-nitro-2-(1-pyrrolyl)phenyl]-1-piperazinyl]-1-propanone
IUPAC NAME: 2,2-dimethyl-1-[4-(4-nitro-2-pyrrol-1-ylphenyl)piperazin-1-yl]propan-1-one
SYSTEMATIC NAME: 2,2-dimethyl-1-[4-(4-nitro-2-pyrrol-1-yl-phenyl)piperazin-1-yl]propan-1-one
MOLECULAR FORMULA: C19H24N4O3
MOLECULAR WEIGHT: 356.41886
SMILES: CC(C)(C)C(=O)N1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])N3C=CC=C3
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Product OPENEYE NAME: [4-(4-nitro-2-pyrrol-1-yl-phenyl)piperazin-1-yl]-(2,4,6-trimethylphenyl)methanone
CAS Name: [4-[4-nitro-2-(1-pyrrolyl)phenyl]-1-piperazinyl]-(2,4,6-trimethylphenyl)methanone
IUPAC NAME: [4-(4-nitro-2-pyrrol-1-ylphenyl)piperazin-1-yl]-(2,4,6-trimethylphenyl)methanone
SYSTEMATIC NAME: [4-(4-nitro-2-pyrrol-1-yl-phenyl)piperazin-1-yl]-(2,4,6-trimethylphenyl)methanone
MOLECULAR FORMULA: C24H26N4O3
MOLECULAR WEIGHT: 418.48824
SMILES: CC1=CC(=C(C(=C1)C)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])N4C=CC=C4)C
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