Sunday, May 5, 2013

All Chemical Compounds Information




Product OPENEYE NAME: [(2R)-2-ethyl-1-piperidyl]-[1-(4-fluorophenyl)sulfonyl-4-piperidyl]methanone
CAS Name: [(2R)-2-ethyl-1-piperidinyl]-[1-(4-fluorophenyl)sulfonyl-4-piperidinyl]methanone
IUPAC NAME: [(2R)-2-ethylpiperidin-1-yl]-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]methanone
SYSTEMATIC NAME: [(2R)-2-ethylpiperidin-1-yl]-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]methanone
MOLECULAR FORMULA: C19H27FN2O3S
MOLECULAR WEIGHT: 382.492683
SMILES: CC[C@@H]1CCCCN1C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F
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Product OPENEYE NAME: [(2S)-2-ethyl-1-piperidyl]-[1-(4-fluorophenyl)sulfonyl-4-piperidyl]methanone
CAS Name: [(2S)-2-ethyl-1-piperidinyl]-[1-(4-fluorophenyl)sulfonyl-4-piperidinyl]methanone
IUPAC NAME: [(2S)-2-ethylpiperidin-1-yl]-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]methanone
SYSTEMATIC NAME: [(2S)-2-ethylpiperidin-1-yl]-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]methanone
MOLECULAR FORMULA: C19H27FN2O3S
MOLECULAR WEIGHT: 382.492683
SMILES: CC[C@H]1CCCCN1C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F
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Product OPENEYE NAME: [4-(methylcarbamoyl)phenyl] 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]pyridine-3-carboxylate
CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-3-pyridinecarboxylic acid [4-(methylcarbamoyl)phenyl] ester
IUPAC NAME: [4-(methylcarbamoyl)phenyl] 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]pyridine-3-carboxylate
SYSTEMATIC NAME: [4-(methylcarbamoyl)phenyl] 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]pyridine-3-carboxylate
MOLECULAR FORMULA: C20H19N3O4S
MOLECULAR WEIGHT: 397.44756
SMILES: CC1=C(C(=NO1)C)CSC2=C(C=CC=N2)C(=O)OC3=CC=C(C=C3)C(=O)NC
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Product OPENEYE NAME: 1-[(2R)-2-ethyl-1-piperidyl]-2-[[4-(4-methoxyphenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanone
CAS Name: 1-[(2R)-2-ethyl-1-piperidinyl]-2-[[4-(4-methoxyphenyl)-5-methyl-1,2,4-triazol-3-yl]thio]ethanone
IUPAC NAME: 1-[(2R)-2-ethylpiperidin-1-yl]-2-[[4-(4-methoxyphenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanone
SYSTEMATIC NAME: 1-[(2R)-2-ethylpiperidin-1-yl]-2-[[4-(4-methoxyphenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanone
MOLECULAR FORMULA: C19H26N4O2S
MOLECULAR WEIGHT: 374.50034
SMILES: CC[C@@H]1CCCCN1C(=O)CSC2=NN=C(N2C3=CC=C(C=C3)OC)C
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Product OPENEYE NAME: N-[2-(cyclopropylcarbamoyl)phenyl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide
CAS Name: N-[2-[(cyclopropylamino)-oxomethyl]phenyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
IUPAC NAME: N-[2-(cyclopropylcarbamoyl)phenyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
SYSTEMATIC NAME: N-[2-(cyclopropylcarbamoyl)phenyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
MOLECULAR FORMULA: C19H20N2O2S
MOLECULAR WEIGHT: 340.4393
SMILES: C1CCC2=C(C1)C(=CS2)C(=O)NC3=CC=CC=C3C(=O)NC4CC4
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Product OPENEYE NAME: 1-[(2S)-2-ethyl-1-piperidyl]-2-[[4-(4-methoxyphenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanone
CAS Name: 1-[(2S)-2-ethyl-1-piperidinyl]-2-[[4-(4-methoxyphenyl)-5-methyl-1,2,4-triazol-3-yl]thio]ethanone
IUPAC NAME: 1-[(2S)-2-ethylpiperidin-1-yl]-2-[[4-(4-methoxyphenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanone
SYSTEMATIC NAME: 1-[(2S)-2-ethylpiperidin-1-yl]-2-[[4-(4-methoxyphenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanone
MOLECULAR FORMULA: C19H26N4O2S
MOLECULAR WEIGHT: 374.50034
SMILES: CC[C@H]1CCCCN1C(=O)CSC2=NN=C(N2C3=CC=C(C=C3)OC)C
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Product OPENEYE NAME: [(2R)-2-ethyl-1-piperidyl]-[1-(p-tolylsulfonyl)-4-piperidyl]methanone
CAS Name: [(2R)-2-ethyl-1-piperidinyl]-[1-(4-methylphenyl)sulfonyl-4-piperidinyl]methanone
IUPAC NAME: [(2R)-2-ethylpiperidin-1-yl]-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]methanone
SYSTEMATIC NAME: [(2R)-2-ethylpiperidin-1-yl]-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]methanone
MOLECULAR FORMULA: C20H30N2O3S
MOLECULAR WEIGHT: 378.5288
SMILES: CC[C@@H]1CCCCN1C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C
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Product OPENEYE NAME: [(2S)-2-ethyl-1-piperidyl]-[1-(p-tolylsulfonyl)-4-piperidyl]methanone
CAS Name: [(2S)-2-ethyl-1-piperidinyl]-[1-(4-methylphenyl)sulfonyl-4-piperidinyl]methanone
IUPAC NAME: [(2S)-2-ethylpiperidin-1-yl]-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]methanone
SYSTEMATIC NAME: [(2S)-2-ethylpiperidin-1-yl]-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]methanone
MOLECULAR FORMULA: C20H30N2O3S
MOLECULAR WEIGHT: 378.5288
SMILES: CC[C@H]1CCCCN1C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C
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Product OPENEYE NAME: [4-(methylcarbamoyl)phenyl] 1-isopropyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylate
CAS Name: 6-phenyl-1-propan-2-yl-4-pyrazolo[3,4-b]pyridinecarboxylic acid [4-(methylcarbamoyl)phenyl] ester
IUPAC NAME: [4-(methylcarbamoyl)phenyl] 6-phenyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxylate
SYSTEMATIC NAME: [4-(methylcarbamoyl)phenyl] 6-phenyl-1-propan-2-yl-pyrazolo[3,4-b]pyridine-4-carboxylate
MOLECULAR FORMULA: C24H22N4O3
MOLECULAR WEIGHT: 414.45648
SMILES: CC(C)N1C2=C(C=N1)C(=CC(=N2)C3=CC=CC=C3)C(=O)OC4=CC=C(C=C4)C(=O)NC
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Product OPENEYE NAME: 2-[[2-(benzylcarbamoylamino)acetyl]amino]-N-cyclopropyl-benzamide
CAS Name: N-cyclopropyl-2-[[1-oxo-2-[[oxo-[(phenylmethyl)amino]methyl]amino]ethyl]amino]benzamide
IUPAC NAME: 2-[[2-(benzylcarbamoylamino)acetyl]amino]-N-cyclopropylbenzamide
SYSTEMATIC NAME: N-cyclopropyl-2-[2-[(phenylmethyl)carbamoylamino]ethanoylamino]benzamide
MOLECULAR FORMULA: C20H22N4O3
MOLECULAR WEIGHT: 366.41368
SMILES: C1CC1NC(=O)C2=CC=CC=C2NC(=O)CNC(=O)NCC3=CC=CC=C3
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Product OPENEYE NAME: [4-(methylcarbamoyl)phenyl] 5-methyl-2-phenyl-triazole-4-carboxylate
CAS Name: 5-methyl-2-phenyl-4-triazolecarboxylic acid [4-(methylcarbamoyl)phenyl] ester
IUPAC NAME: [4-(methylcarbamoyl)phenyl] 5-methyl-2-phenyltriazole-4-carboxylate
SYSTEMATIC NAME: [4-(methylcarbamoyl)phenyl] 5-methyl-2-phenyl-1,2,3-triazole-4-carboxylate
MOLECULAR FORMULA: C18H16N4O3
MOLECULAR WEIGHT: 336.34464
SMILES: CC1=NN(N=C1C(=O)OC2=CC=C(C=C2)C(=O)NC)C3=CC=CC=C3
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Product OPENEYE NAME: 2-(2,5-difluorophenyl)sulfanyl-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]acetamide
CAS Name: 2-[(2,5-difluorophenyl)thio]-N-[[4-[oxo(1-pyrrolidinyl)methyl]phenyl]methyl]acetamide
IUPAC NAME: 2-(2,5-difluorophenyl)sulfanyl-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]acetamide
SYSTEMATIC NAME: 2-[2,5-bis(fluoranyl)phenyl]sulfanyl-N-[(4-pyrrolidin-1-ylcarbonylphenyl)methyl]ethanamide
MOLECULAR FORMULA: C20H20F2N2O2S
MOLECULAR WEIGHT: 390.446806
SMILES: C1CCN(C1)C(=O)C2=CC=C(C=C2)CNC(=O)CSC3=C(C=CC(=C3)F)F
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Product OPENEYE NAME: [1-(2,4-dimethylphenyl)sulfonyl-4-piperidyl]-[(2R)-2-ethyl-1-piperidyl]methanone
CAS Name: [1-(2,4-dimethylphenyl)sulfonyl-4-piperidinyl]-[(2R)-2-ethyl-1-piperidinyl]methanone
IUPAC NAME: [1-(2,4-dimethylphenyl)sulfonylpiperidin-4-yl]-[(2R)-2-ethylpiperidin-1-yl]methanone
SYSTEMATIC NAME: [1-(2,4-dimethylphenyl)sulfonylpiperidin-4-yl]-[(2R)-2-ethylpiperidin-1-yl]methanone
MOLECULAR FORMULA: C21H32N2O3S
MOLECULAR WEIGHT: 392.55538
SMILES: CC[C@@H]1CCCCN1C(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=C(C=C3)C)C
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Product OPENEYE NAME: [1-(2,4-dimethylphenyl)sulfonyl-4-piperidyl]-[(2S)-2-ethyl-1-piperidyl]methanone
CAS Name: [1-(2,4-dimethylphenyl)sulfonyl-4-piperidinyl]-[(2S)-2-ethyl-1-piperidinyl]methanone
IUPAC NAME: [1-(2,4-dimethylphenyl)sulfonylpiperidin-4-yl]-[(2S)-2-ethylpiperidin-1-yl]methanone
SYSTEMATIC NAME: [1-(2,4-dimethylphenyl)sulfonylpiperidin-4-yl]-[(2S)-2-ethylpiperidin-1-yl]methanone
MOLECULAR FORMULA: C21H32N2O3S
MOLECULAR WEIGHT: 392.55538
SMILES: CC[C@H]1CCCCN1C(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=C(C=C3)C)C
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Product OPENEYE NAME: (4-chloro-3-methylsulfonyl-phenyl)-[(2R)-2-ethyl-1-piperidyl]methanone
CAS Name: (4-chloro-3-methylsulfonylphenyl)-[(2R)-2-ethyl-1-piperidinyl]methanone
IUPAC NAME: (4-chloro-3-methylsulfonylphenyl)-[(2R)-2-ethylpiperidin-1-yl]methanone
SYSTEMATIC NAME: (4-chloranyl-3-methylsulfonyl-phenyl)-[(2R)-2-ethylpiperidin-1-yl]methanone
MOLECULAR FORMULA: C15H20ClNO3S
MOLECULAR WEIGHT: 329.8422
SMILES: CC[C@@H]1CCCCN1C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)C
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Product OPENEYE NAME: N-[3-[[[2-(2,5-difluorophenyl)sulfanylacetyl]amino]methyl]phenyl]cyclopropanecarboxamide
CAS Name: N-[3-[[[2-[(2,5-difluorophenyl)thio]-1-oxoethyl]amino]methyl]phenyl]cyclopropanecarboxamide
IUPAC NAME: N-[3-[[[2-(2,5-difluorophenyl)sulfanylacetyl]amino]methyl]phenyl]cyclopropanecarboxamide
SYSTEMATIC NAME: N-[3-[[2-[2,5-bis(fluoranyl)phenyl]sulfanylethanoylamino]methyl]phenyl]cyclopropanecarboxamide
MOLECULAR FORMULA: C19H18F2N2O2S
MOLECULAR WEIGHT: 376.420226
SMILES: C1CC1C(=O)NC2=CC=CC(=C2)CNC(=O)CSC3=C(C=CC(=C3)F)F
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Product OPENEYE NAME: (4-chloro-3-methylsulfonyl-phenyl)-[(2S)-2-ethyl-1-piperidyl]methanone
CAS Name: (4-chloro-3-methylsulfonylphenyl)-[(2S)-2-ethyl-1-piperidinyl]methanone
IUPAC NAME: (4-chloro-3-methylsulfonylphenyl)-[(2S)-2-ethylpiperidin-1-yl]methanone
SYSTEMATIC NAME: (4-chloranyl-3-methylsulfonyl-phenyl)-[(2S)-2-ethylpiperidin-1-yl]methanone
MOLECULAR FORMULA: C15H20ClNO3S
MOLECULAR WEIGHT: 329.8422
SMILES: CC[C@H]1CCCCN1C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)C
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Product OPENEYE NAME: [5-(benzenesulfonylmethyl)-2-furyl]-[(2R)-2-ethyl-1-piperidyl]methanone
CAS Name: [5-(benzenesulfonylmethyl)-2-furanyl]-[(2R)-2-ethyl-1-piperidinyl]methanone
IUPAC NAME: [5-(benzenesulfonylmethyl)furan-2-yl]-[(2R)-2-ethylpiperidin-1-yl]methanone
SYSTEMATIC NAME: [(2R)-2-ethylpiperidin-1-yl]-[5-(phenylsulfonylmethyl)furan-2-yl]methanone
MOLECULAR FORMULA: C19H23NO4S
MOLECULAR WEIGHT: 361.45522
SMILES: CC[C@@H]1CCCCN1C(=O)C2=CC=C(O2)CS(=O)(=O)C3=CC=CC=C3
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Product OPENEYE NAME: [5-(benzenesulfonylmethyl)-2-furyl]-[(2S)-2-ethyl-1-piperidyl]methanone
CAS Name: [5-(benzenesulfonylmethyl)-2-furanyl]-[(2S)-2-ethyl-1-piperidinyl]methanone
IUPAC NAME: [5-(benzenesulfonylmethyl)furan-2-yl]-[(2S)-2-ethylpiperidin-1-yl]methanone
SYSTEMATIC NAME: [(2S)-2-ethylpiperidin-1-yl]-[5-(phenylsulfonylmethyl)furan-2-yl]methanone
MOLECULAR FORMULA: C19H23NO4S
MOLECULAR WEIGHT: 361.45522
SMILES: CC[C@H]1CCCCN1C(=O)C2=CC=C(O2)CS(=O)(=O)C3=CC=CC=C3
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Product OPENEYE NAME: N,N-diethyl-5-[(2R)-2-ethylpiperidine-1-carbonyl]-2-methoxy-benzenesulfonamide
CAS Name: N,N-diethyl-5-[[(2R)-2-ethyl-1-piperidinyl]-oxomethyl]-2-methoxybenzenesulfonamide
IUPAC NAME: N,N-diethyl-5-[(2R)-2-ethylpiperidine-1-carbonyl]-2-methoxybenzenesulfonamide
SYSTEMATIC NAME: N,N-diethyl-5-[(2R)-2-ethylpiperidin-1-yl]carbonyl-2-methoxy-benzenesulfonamide
MOLECULAR FORMULA: C19H30N2O4S
MOLECULAR WEIGHT: 382.5175
SMILES: CC[C@@H]1CCCCN1C(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N(CC)CC
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Product OPENEYE NAME: N,N-diethyl-5-[(2S)-2-ethylpiperidine-1-carbonyl]-2-methoxy-benzenesulfonamide
CAS Name: N,N-diethyl-5-[[(2S)-2-ethyl-1-piperidinyl]-oxomethyl]-2-methoxybenzenesulfonamide
IUPAC NAME: N,N-diethyl-5-[(2S)-2-ethylpiperidine-1-carbonyl]-2-methoxybenzenesulfonamide
SYSTEMATIC NAME: N,N-diethyl-5-[(2S)-2-ethylpiperidin-1-yl]carbonyl-2-methoxy-benzenesulfonamide
MOLECULAR FORMULA: C19H30N2O4S
MOLECULAR WEIGHT: 382.5175
SMILES: CC[C@H]1CCCCN1C(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N(CC)CC
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