Thursday, December 29, 2011

All Chemical Compounds Information




Product OPENEYE NAME: (2R)-N-[(1S)-2-[(6-amino-3-pyridyl)methylamino]-1-[(4-fluorophenyl)methyl]-2-oxo-ethyl]-1-isopropyl-pyrrolidine-2-carboxamide
CAS Name: (2R)-N-[(2S)-1-[(6-amino-3-pyridinyl)methylamino]-3-(4-fluorophenyl)-1-oxopropan-2-yl]-1-propan-2-yl-2-pyrrolidinecarboxamide
IUPAC NAME: (2R)-N-[(2S)-1-[(6-aminopyridin-3-yl)methylamino]-3-(4-fluorophenyl)-1-oxopropan-2-yl]-1-propan-2-ylpyrrolidine-2-carboxamide
SYSTEMATIC NAME: (2R)-N-[(2S)-1-[(6-azanylpyridin-3-yl)methylamino]-3-(4-fluorophenyl)-1-oxidanylidene-propan-2-yl]-1-propan-2-yl-pyrrolidine-2-carboxamide
MOLECULAR FORMULA: C23H30FN5O2
MOLECULAR WEIGHT: 427.515003
SMILES: CC(C)N1CCC[C@@H]1C(=O)N[C@@H](CC2=CC=C(C=C2)F)C(=O)NCC3=CN=C(C=C3)N
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Product OPENEYE NAME: (2R)-N-[(1S)-2-[(6-amino-3-pyridyl)methylamino]-1-[(3,4-difluorophenyl)methyl]-2-oxo-ethyl]-1-ethyl-pyrrolidine-2-carboxamide
CAS Name: (2R)-N-[(2S)-1-[(6-amino-3-pyridinyl)methylamino]-3-(3,4-difluorophenyl)-1-oxopropan-2-yl]-1-ethyl-2-pyrrolidinecarboxamide
IUPAC NAME: (2R)-N-[(2S)-1-[(6-aminopyridin-3-yl)methylamino]-3-(3,4-difluorophenyl)-1-oxopropan-2-yl]-1-ethylpyrrolidine-2-carboxamide
SYSTEMATIC NAME: (2R)-N-[(2S)-1-[(6-azanylpyridin-3-yl)methylamino]-3-[3,4-bis(fluoranyl)phenyl]-1-oxidanylidene-propan-2-yl]-1-ethyl-pyrrolidine-2-carboxamide
MOLECULAR FORMULA: C22H27F2N5O2
MOLECULAR WEIGHT: 431.478886
SMILES: CCN1CCC[C@@H]1C(=O)N[C@@H](CC2=CC(=C(C=C2)F)F)C(=O)NCC3=CN=C(C=C3)N
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Product OPENEYE NAME: (2R)-N-[(1S)-2-[(6-amino-3-pyridyl)methylamino]-1-[(3,4-difluorophenyl)methyl]-2-oxo-ethyl]-1-propyl-pyrrolidine-2-carboxamide
CAS Name: (2R)-N-[(2S)-1-[(6-amino-3-pyridinyl)methylamino]-3-(3,4-difluorophenyl)-1-oxopropan-2-yl]-1-propyl-2-pyrrolidinecarboxamide
IUPAC NAME: (2R)-N-[(2S)-1-[(6-aminopyridin-3-yl)methylamino]-3-(3,4-difluorophenyl)-1-oxopropan-2-yl]-1-propylpyrrolidine-2-carboxamide
SYSTEMATIC NAME: (2R)-N-[(2S)-1-[(6-azanylpyridin-3-yl)methylamino]-3-[3,4-bis(fluoranyl)phenyl]-1-oxidanylidene-propan-2-yl]-1-propyl-pyrrolidine-2-carboxamide
MOLECULAR FORMULA: C23H29F2N5O2
MOLECULAR WEIGHT: 445.505466
SMILES: CCCN1CCC[C@@H]1C(=O)N[C@@H](CC2=CC(=C(C=C2)F)F)C(=O)NCC3=CN=C(C=C3)N
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Product OPENEYE NAME: (2R)-N-[(1S)-2-[(6-amino-3-pyridyl)methylamino]-1-[(3,4-difluorophenyl)methyl]-2-oxo-ethyl]-1-isobutyl-pyrrolidine-2-carboxamide
CAS Name: (2R)-N-[(2S)-1-[(6-amino-3-pyridinyl)methylamino]-3-(3,4-difluorophenyl)-1-oxopropan-2-yl]-1-(2-methylpropyl)-2-pyrrolidinecarboxamide
IUPAC NAME: (2R)-N-[(2S)-1-[(6-aminopyridin-3-yl)methylamino]-3-(3,4-difluorophenyl)-1-oxopropan-2-yl]-1-(2-methylpropyl)pyrrolidine-2-carboxamide
SYSTEMATIC NAME: (2R)-N-[(2S)-1-[(6-azanylpyridin-3-yl)methylamino]-3-[3,4-bis(fluoranyl)phenyl]-1-oxidanylidene-propan-2-yl]-1-(2-methylpropyl)pyrrolidine-2-carboxamide
MOLECULAR FORMULA: C24H31F2N5O2
MOLECULAR WEIGHT: 459.532046
SMILES: CC(C)CN1CCC[C@@H]1C(=O)N[C@@H](CC2=CC(=C(C=C2)F)F)C(=O)NCC3=CN=C(C=C3)N
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Product OPENEYE NAME: 1-[1-(2-methylpyridine-3-carbonyl)-4-piperidyl]-3-[4-(trifluoromethoxy)phenyl]urea
CAS Name: 1-[1-[(2-methyl-3-pyridinyl)-oxomethyl]-4-piperidinyl]-3-[4-(trifluoromethoxy)phenyl]urea
IUPAC NAME: 1-[1-(2-methylpyridine-3-carbonyl)piperidin-4-yl]-3-[4-(trifluoromethoxy)phenyl]urea
SYSTEMATIC NAME: 1-[1-(2-methylpyridin-3-yl)carbonylpiperidin-4-yl]-3-[4-(trifluoromethyloxy)phenyl]urea
MOLECULAR FORMULA: C20H21F3N4O3
MOLECULAR WEIGHT: 422.40095
SMILES: CC1=C(C=CC=N1)C(=O)N2CCC(CC2)NC(=O)NC3=CC=C(C=C3)OC(F)(F)F
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Product OPENEYE NAME: 1-[1-(6-methylpyridine-3-carbonyl)-4-piperidyl]-3-[4-(trifluoromethoxy)phenyl]urea
CAS Name: 1-[1-[(6-methyl-3-pyridinyl)-oxomethyl]-4-piperidinyl]-3-[4-(trifluoromethoxy)phenyl]urea
IUPAC NAME: 1-[1-(6-methylpyridine-3-carbonyl)piperidin-4-yl]-3-[4-(trifluoromethoxy)phenyl]urea
SYSTEMATIC NAME: 1-[1-(6-methylpyridin-3-yl)carbonylpiperidin-4-yl]-3-[4-(trifluoromethyloxy)phenyl]urea
MOLECULAR FORMULA: C20H21F3N4O3
MOLECULAR WEIGHT: 422.40095
SMILES: CC1=NC=C(C=C1)C(=O)N2CCC(CC2)NC(=O)NC3=CC=C(C=C3)OC(F)(F)F
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Product OPENEYE NAME: 1-[1-(3-pyridylsulfonyl)-4-piperidyl]-3-[4-(trifluoromethoxy)phenyl]urea
CAS Name: 1-[1-(3-pyridinylsulfonyl)-4-piperidinyl]-3-[4-(trifluoromethoxy)phenyl]urea
IUPAC NAME: 1-(1-pyridin-3-ylsulfonylpiperidin-4-yl)-3-[4-(trifluoromethoxy)phenyl]urea
SYSTEMATIC NAME: 1-(1-pyridin-3-ylsulfonylpiperidin-4-yl)-3-[4-(trifluoromethyloxy)phenyl]urea
MOLECULAR FORMULA: C18H19F3N4O4S
MOLECULAR WEIGHT: 444.42807
SMILES: C1CN(CCC1NC(=O)NC2=CC=C(C=C2)OC(F)(F)F)S(=O)(=O)C3=CN=CC=C3
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Product OPENEYE NAME: 1-[1-(5-fluoropyridine-3-carbonyl)-4-piperidyl]-3-[4-(trifluoromethoxy)phenyl]urea
CAS Name: 1-[1-[(5-fluoro-3-pyridinyl)-oxomethyl]-4-piperidinyl]-3-[4-(trifluoromethoxy)phenyl]urea
IUPAC NAME: 1-[1-(5-fluoropyridine-3-carbonyl)piperidin-4-yl]-3-[4-(trifluoromethoxy)phenyl]urea
SYSTEMATIC NAME: 1-[1-(5-fluoranylpyridin-3-yl)carbonylpiperidin-4-yl]-3-[4-(trifluoromethyloxy)phenyl]urea
MOLECULAR FORMULA: C19H18F4N4O3
MOLECULAR WEIGHT: 426.364833
SMILES: C1CN(CCC1NC(=O)NC2=CC=C(C=C2)OC(F)(F)F)C(=O)C3=CC(=CN=C3)F
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Product OPENEYE NAME: 1-[1-(pyridine-4-carbonyl)-4-piperidyl]-3-[4-(trifluoromethoxy)phenyl]urea
CAS Name: 1-[1-[oxo(pyridin-4-yl)methyl]-4-piperidinyl]-3-[4-(trifluoromethoxy)phenyl]urea
IUPAC NAME: 1-[1-(pyridine-4-carbonyl)piperidin-4-yl]-3-[4-(trifluoromethoxy)phenyl]urea
SYSTEMATIC NAME: 1-(1-pyridin-4-ylcarbonylpiperidin-4-yl)-3-[4-(trifluoromethyloxy)phenyl]urea
MOLECULAR FORMULA: C19H19F3N4O3
MOLECULAR WEIGHT: 408.37437
SMILES: C1CN(CCC1NC(=O)NC2=CC=C(C=C2)OC(F)(F)F)C(=O)C3=CC=NC=C3
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Product OPENEYE NAME: 1-[1-(6-methoxypyridine-3-carbonyl)-4-piperidyl]-3-[4-(trifluoromethoxy)phenyl]urea
CAS Name: 1-[1-[(6-methoxy-3-pyridinyl)-oxomethyl]-4-piperidinyl]-3-[4-(trifluoromethoxy)phenyl]urea
IUPAC NAME: 1-[1-(6-methoxypyridine-3-carbonyl)piperidin-4-yl]-3-[4-(trifluoromethoxy)phenyl]urea
SYSTEMATIC NAME: 1-[1-(6-methoxypyridin-3-yl)carbonylpiperidin-4-yl]-3-[4-(trifluoromethyloxy)phenyl]urea
MOLECULAR FORMULA: C20H21F3N4O4
MOLECULAR WEIGHT: 438.40035
SMILES: COC1=NC=C(C=C1)C(=O)N2CCC(CC2)NC(=O)NC3=CC=C(C=C3)OC(F)(F)F
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Product OPENEYE NAME: 4-(4-chlorobenzoyl)-3-hydroxy-5-(4-methoxyphenyl)-1-(2-morpholinoethyl)-3H-pyrrol-2-one
CAS Name: 4-[(4-chlorophenyl)-oxomethyl]-3-hydroxy-5-(4-methoxyphenyl)-1-[2-(4-morpholinyl)ethyl]-3H-pyrrol-2-one
IUPAC NAME: 4-(4-chlorobenzoyl)-3-hydroxy-5-(4-methoxyphenyl)-1-(2-morpholin-4-ylethyl)-3H-pyrrol-2-one
SYSTEMATIC NAME: 4-(4-chlorophenyl)carbonyl-5-(4-methoxyphenyl)-1-(2-morpholin-4-ylethyl)-3-oxidanyl-3H-pyrrol-2-one
MOLECULAR FORMULA: C24H25ClN2O5
MOLECULAR WEIGHT: 456.9187
SMILES: COC1=CC=C(C=C1)C2=C(C(C(=O)N2CCN3CCOCC3)O)C(=O)C4=CC=C(C=C4)Cl
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Product OPENEYE NAME: 5-(2,5-dimethoxyphenyl)-4-(4-fluorobenzoyl)-3-hydroxy-1-(3-morpholinopropyl)-3H-pyrrol-2-one
CAS Name: 5-(2,5-dimethoxyphenyl)-4-[(4-fluorophenyl)-oxomethyl]-3-hydroxy-1-[3-(4-morpholinyl)propyl]-3H-pyrrol-2-one
IUPAC NAME: 5-(2,5-dimethoxyphenyl)-4-(4-fluorobenzoyl)-3-hydroxy-1-(3-morpholin-4-ylpropyl)-3H-pyrrol-2-one
SYSTEMATIC NAME: 5-(2,5-dimethoxyphenyl)-4-(4-fluorophenyl)carbonyl-1-(3-morpholin-4-ylpropyl)-3-oxidanyl-3H-pyrrol-2-one
MOLECULAR FORMULA: C26H29FN2O6
MOLECULAR WEIGHT: 484.516663
SMILES: COC1=CC(=C(C=C1)OC)C2=C(C(C(=O)N2CCCN3CCOCC3)O)C(=O)C4=CC=C(C=C4)F
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Product OPENEYE NAME: 4-(4-chlorobenzoyl)-5-(2-fluorophenyl)-3-hydroxy-1-(3-morpholinopropyl)-3H-pyrrol-2-one
CAS Name: 4-[(4-chlorophenyl)-oxomethyl]-5-(2-fluorophenyl)-3-hydroxy-1-[3-(4-morpholinyl)propyl]-3H-pyrrol-2-one
IUPAC NAME: 4-(4-chlorobenzoyl)-5-(2-fluorophenyl)-3-hydroxy-1-(3-morpholin-4-ylpropyl)-3H-pyrrol-2-one
SYSTEMATIC NAME: 4-(4-chlorophenyl)carbonyl-5-(2-fluorophenyl)-1-(3-morpholin-4-ylpropyl)-3-oxidanyl-3H-pyrrol-2-one
MOLECULAR FORMULA: C24H24ClFN2O4
MOLECULAR WEIGHT: 458.909763
SMILES: C1COCCN1CCCN2C(=O)C(C(=C2C3=CC=CC=C3F)C(=O)C4=CC=C(C=C4)Cl)O
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Product OPENEYE NAME: N-(3-methoxy-2-pyridyl)-3-(1-piperidylsulfonyl)benzamide
CAS Name: N-(3-methoxy-2-pyridinyl)-3-(1-piperidinylsulfonyl)benzamide
IUPAC NAME: N-(3-methoxypyridin-2-yl)-3-piperidin-1-ylsulfonylbenzamide
SYSTEMATIC NAME: N-(3-methoxypyridin-2-yl)-3-piperidin-1-ylsulfonyl-benzamide
MOLECULAR FORMULA: C18H21N3O4S
MOLECULAR WEIGHT: 375.44204
SMILES: COC1=C(N=CC=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3
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Product OPENEYE NAME: N-(5-cyclopropyl-1H-pyrazol-3-yl)-3-(1-piperidylsulfonyl)benzamide
CAS Name: N-(5-cyclopropyl-1H-pyrazol-3-yl)-3-(1-piperidinylsulfonyl)benzamide
IUPAC NAME: N-(5-cyclopropyl-1H-pyrazol-3-yl)-3-piperidin-1-ylsulfonylbenzamide
SYSTEMATIC NAME: N-(5-cyclopropyl-1H-pyrazol-3-yl)-3-piperidin-1-ylsulfonyl-benzamide
MOLECULAR FORMULA: C18H22N4O3S
MOLECULAR WEIGHT: 374.45728
SMILES: C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=NNC(=C3)C4CC4
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Product OPENEYE NAME: N-(3-propoxy-1H-pyrazol-5-yl)-3-(2-pyridylsulfonyl)benzamide
CAS Name: N-(3-propoxy-1H-pyrazol-5-yl)-3-(2-pyridinylsulfonyl)benzamide
IUPAC NAME: N-(3-propoxy-1H-pyrazol-5-yl)-3-pyridin-2-ylsulfonylbenzamide
SYSTEMATIC NAME: N-(3-propoxy-1H-pyrazol-5-yl)-3-pyridin-2-ylsulfonyl-benzamide
MOLECULAR FORMULA: C18H18N4O4S
MOLECULAR WEIGHT: 386.42492
SMILES: CCCOC1=NNC(=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)C3=CC=CC=N3
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Product OPENEYE NAME: 3-cyclohexylsulfonyl-N-(4-isopropoxyphenyl)benzamide
CAS Name: 3-cyclohexylsulfonyl-N-(4-propan-2-yloxyphenyl)benzamide
IUPAC NAME: 3-cyclohexylsulfonyl-N-(4-propan-2-yloxyphenyl)benzamide
SYSTEMATIC NAME: 3-cyclohexylsulfonyl-N-(4-propan-2-yloxyphenyl)benzamide
MOLECULAR FORMULA: C22H27NO4S
MOLECULAR WEIGHT: 401.51908
SMILES: CC(C)OC1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)C3CCCCC3
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Product OPENEYE NAME: N-(4-isopropoxyphenyl)-3-[2-(phenoxymethyl)morpholin-4-yl]sulfonyl-benzamide
CAS Name: 3-[[2-(phenoxymethyl)-4-morpholinyl]sulfonyl]-N-(4-propan-2-yloxyphenyl)benzamide
IUPAC NAME: 3-[2-(phenoxymethyl)morpholin-4-yl]sulfonyl-N-(4-propan-2-yloxyphenyl)benzamide
SYSTEMATIC NAME: 3-[2-(phenoxymethyl)morpholin-4-yl]sulfonyl-N-(4-propan-2-yloxyphenyl)benzamide
MOLECULAR FORMULA: C27H30N2O6S
MOLECULAR WEIGHT: 510.6019
SMILES: CC(C)OC1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCOC(C3)COC4=CC=CC=C4
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