Monday, October 1, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 1-[[3-(m-tolyl)-1,2,4-oxadiazol-5-yl]methyl]-N-[[(2S)-tetrahydrofuran-2-yl]methyl]piperidin-1-ium-4-carboxamide
CAS Name: 1-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-[[(2S)-2-oxolanyl]methyl]-4-piperidin-1-iumcarboxamide
IUPAC NAME: 1-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-[[(2S)-oxolan-2-yl]methyl]piperidin-1-ium-4-carboxamide
SYSTEMATIC NAME: 1-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-[[(2S)-oxolan-2-yl]methyl]piperidin-1-ium-4-carboxamide
MOLECULAR FORMULA: C21H29N4O3+
MOLECULAR WEIGHT: 385.47996
SMILES: CC1=CC=CC(=C1)C2=NOC(=N2)C[NH+]3CCC(CC3)C(=O)NC[C@@H]4CCCO4
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Product OPENEYE NAME: 1-[[3-(m-tolyl)-1,2,4-oxadiazol-5-yl]methyl]-N-[[(2S)-tetrahydrofuran-2-yl]methyl]piperidine-4-carboxamide
CAS Name: 1-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-[[(2S)-2-oxolanyl]methyl]-4-piperidinecarboxamide
IUPAC NAME: 1-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-[[(2S)-oxolan-2-yl]methyl]piperidine-4-carboxamide
SYSTEMATIC NAME: 1-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-[[(2S)-oxolan-2-yl]methyl]piperidine-4-carboxamide
MOLECULAR FORMULA: C21H28N4O3
MOLECULAR WEIGHT: 384.47202
SMILES: CC1=CC=CC(=C1)C2=NOC(=N2)CN3CCC(CC3)C(=O)NC[C@@H]4CCCO4
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Product OPENEYE NAME: 1-[[3-(m-tolyl)-1,2,4-oxadiazol-5-yl]methyl]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]piperidin-1-ium-4-carboxamide
CAS Name: 1-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-[[(2R)-2-oxolanyl]methyl]-4-piperidin-1-iumcarboxamide
IUPAC NAME: 1-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-[[(2R)-oxolan-2-yl]methyl]piperidin-1-ium-4-carboxamide
SYSTEMATIC NAME: 1-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-[[(2R)-oxolan-2-yl]methyl]piperidin-1-ium-4-carboxamide
MOLECULAR FORMULA: C21H29N4O3+
MOLECULAR WEIGHT: 385.47996
SMILES: CC1=CC=CC(=C1)C2=NOC(=N2)C[NH+]3CCC(CC3)C(=O)NC[C@H]4CCCO4
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Product OPENEYE NAME: 1-[[3-(m-tolyl)-1,2,4-oxadiazol-5-yl]methyl]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]piperidine-4-carboxamide
CAS Name: 1-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-[[(2R)-2-oxolanyl]methyl]-4-piperidinecarboxamide
IUPAC NAME: 1-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-[[(2R)-oxolan-2-yl]methyl]piperidine-4-carboxamide
SYSTEMATIC NAME: 1-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-[[(2R)-oxolan-2-yl]methyl]piperidine-4-carboxamide
MOLECULAR FORMULA: C21H28N4O3
MOLECULAR WEIGHT: 384.47202
SMILES: CC1=CC=CC(=C1)C2=NOC(=N2)CN3CCC(CC3)C(=O)NC[C@H]4CCCO4
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Product OPENEYE NAME: 6-methoxy-N-methyl-N-[(1S)-1,2,2-trimethylpropyl]-1H-indole-2-carboxamide
CAS Name: N-[(2S)-3,3-dimethylbutan-2-yl]-6-methoxy-N-methyl-1H-indole-2-carboxamide
IUPAC NAME: N-[(2S)-3,3-dimethylbutan-2-yl]-6-methoxy-N-methyl-1H-indole-2-carboxamide
SYSTEMATIC NAME: N-[(2S)-3,3-dimethylbutan-2-yl]-6-methoxy-N-methyl-1H-indole-2-carboxamide
MOLECULAR FORMULA: C17H24N2O2
MOLECULAR WEIGHT: 288.38466
SMILES: C[C@@H](C(C)(C)C)N(C)C(=O)C1=CC2=C(N1)C=C(C=C2)OC
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Product OPENEYE NAME: 6-methoxy-N-methyl-N-[(1R)-1,2,2-trimethylpropyl]-1H-indole-2-carboxamide
CAS Name: N-[(2R)-3,3-dimethylbutan-2-yl]-6-methoxy-N-methyl-1H-indole-2-carboxamide
IUPAC NAME: N-[(2R)-3,3-dimethylbutan-2-yl]-6-methoxy-N-methyl-1H-indole-2-carboxamide
SYSTEMATIC NAME: N-[(2R)-3,3-dimethylbutan-2-yl]-6-methoxy-N-methyl-1H-indole-2-carboxamide
MOLECULAR FORMULA: C17H24N2O2
MOLECULAR WEIGHT: 288.38466
SMILES: C[C@H](C(C)(C)C)N(C)C(=O)C1=CC2=C(N1)C=C(C=C2)OC
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Product OPENEYE NAME: N-[4-(difluoromethylsulfanyl)phenyl]-4-fluoro-3-pyrrolidin-1-ylsulfonyl-benzamide
CAS Name: N-[4-(difluoromethylthio)phenyl]-4-fluoro-3-(1-pyrrolidinylsulfonyl)benzamide
IUPAC NAME: N-[4-(difluoromethylsulfanyl)phenyl]-4-fluoro-3-pyrrolidin-1-ylsulfonylbenzamide
SYSTEMATIC NAME: N-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-4-fluoranyl-3-pyrrolidin-1-ylsulfonyl-benzamide
MOLECULAR FORMULA: C18H17F3N2O3S2
MOLECULAR WEIGHT: 430.46439
SMILES: C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC=C(C=C3)SC(F)F)F
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Product OPENEYE NAME: N-methyl-1-[[3-(m-tolyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-1-ium-4-carboxamide
CAS Name: N-methyl-1-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-4-piperidin-1-iumcarboxamide
IUPAC NAME: N-methyl-1-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-1-ium-4-carboxamide
SYSTEMATIC NAME: N-methyl-1-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-1-ium-4-carboxamide
MOLECULAR FORMULA: C17H23N4O2+
MOLECULAR WEIGHT: 315.39012
SMILES: CC1=CC=CC(=C1)C2=NOC(=N2)C[NH+]3CCC(CC3)C(=O)NC
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Product OPENEYE NAME: N-methyl-1-[[3-(m-tolyl)-1,2,4-oxadiazol-5-yl]methyl]piperidine-4-carboxamide
CAS Name: N-methyl-1-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-4-piperidinecarboxamide
IUPAC NAME: N-methyl-1-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidine-4-carboxamide
SYSTEMATIC NAME: N-methyl-1-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidine-4-carboxamide
MOLECULAR FORMULA: C17H22N4O2
MOLECULAR WEIGHT: 314.38218
SMILES: CC1=CC=CC(=C1)C2=NOC(=N2)CN3CCC(CC3)C(=O)NC
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Product OPENEYE NAME: N-methyl-5-propyl-N-[(1S)-1,2,2-trimethylpropyl]-1H-pyrazole-3-carboxamide
CAS Name: N-[(2S)-3,3-dimethylbutan-2-yl]-N-methyl-5-propyl-1H-pyrazole-3-carboxamide
IUPAC NAME: N-[(2S)-3,3-dimethylbutan-2-yl]-N-methyl-5-propyl-1H-pyrazole-3-carboxamide
SYSTEMATIC NAME: N-[(2S)-3,3-dimethylbutan-2-yl]-N-methyl-5-propyl-1H-pyrazole-3-carboxamide
MOLECULAR FORMULA: C14H25N3O
MOLECULAR WEIGHT: 251.3678
SMILES: CCCC1=CC(=NN1)C(=O)N(C)[C@@H](C)C(C)(C)C
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Product OPENEYE NAME: 4-[[[butyl(methyl)sulfamoyl]amino]methyl]-2-(cyclopentoxy)pyridine
CAS Name: 4-[[[butyl(methyl)sulfamoyl]amino]methyl]-2-cyclopentyloxypyridine
IUPAC NAME: 4-[[[butyl(methyl)sulfamoyl]amino]methyl]-2-cyclopentyloxypyridine
SYSTEMATIC NAME: 4-[[[butyl(methyl)sulfamoyl]amino]methyl]-2-cyclopentyloxy-pyridine
MOLECULAR FORMULA: C16H27N3O3S
MOLECULAR WEIGHT: 341.46888
SMILES: CCCCN(C)S(=O)(=O)NCC1=CC(=NC=C1)OC2CCCC2
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Product OPENEYE NAME: N-methyl-5-propyl-N-[(1R)-1,2,2-trimethylpropyl]-1H-pyrazole-3-carboxamide
CAS Name: N-[(2R)-3,3-dimethylbutan-2-yl]-N-methyl-5-propyl-1H-pyrazole-3-carboxamide
IUPAC NAME: N-[(2R)-3,3-dimethylbutan-2-yl]-N-methyl-5-propyl-1H-pyrazole-3-carboxamide
SYSTEMATIC NAME: N-[(2R)-3,3-dimethylbutan-2-yl]-N-methyl-5-propyl-1H-pyrazole-3-carboxamide
MOLECULAR FORMULA: C14H25N3O
MOLECULAR WEIGHT: 251.3678
SMILES: CCCC1=CC(=NN1)C(=O)N(C)[C@H](C)C(C)(C)C
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Product OPENEYE NAME: N-[[2-(cyclopentoxy)-4-pyridyl]methyl]methanesulfonamide
CAS Name: N-[(2-cyclopentyloxy-4-pyridinyl)methyl]methanesulfonamide
IUPAC NAME: N-[(2-cyclopentyloxypyridin-4-yl)methyl]methanesulfonamide
SYSTEMATIC NAME: N-[(2-cyclopentyloxypyridin-4-yl)methyl]methanesulfonamide
MOLECULAR FORMULA: C12H18N2O3S
MOLECULAR WEIGHT: 270.34792
SMILES: CS(=O)(=O)NCC1=CC(=NC=C1)OC2CCCC2
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Product OPENEYE NAME: (2R)-N-[[2-(cyclopentoxy)-4-pyridyl]methyl]-2-methyl-piperidine-1-sulfonamide
CAS Name: (2R)-N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-2-methyl-1-piperidinesulfonamide
IUPAC NAME: (2R)-N-[(2-cyclopentyloxypyridin-4-yl)methyl]-2-methylpiperidine-1-sulfonamide
SYSTEMATIC NAME: (2R)-N-[(2-cyclopentyloxypyridin-4-yl)methyl]-2-methyl-piperidine-1-sulfonamide
MOLECULAR FORMULA: C17H27N3O3S
MOLECULAR WEIGHT: 353.47958
SMILES: C[C@@H]1CCCCN1S(=O)(=O)NCC2=CC(=NC=C2)OC3CCCC3
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Product OPENEYE NAME: (2S)-N-[[2-(cyclopentoxy)-4-pyridyl]methyl]-2-methyl-piperidine-1-sulfonamide
CAS Name: (2S)-N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-2-methyl-1-piperidinesulfonamide
IUPAC NAME: (2S)-N-[(2-cyclopentyloxypyridin-4-yl)methyl]-2-methylpiperidine-1-sulfonamide
SYSTEMATIC NAME: (2S)-N-[(2-cyclopentyloxypyridin-4-yl)methyl]-2-methyl-piperidine-1-sulfonamide
MOLECULAR FORMULA: C17H27N3O3S
MOLECULAR WEIGHT: 353.47958
SMILES: C[C@H]1CCCCN1S(=O)(=O)NCC2=CC(=NC=C2)OC3CCCC3
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Product OPENEYE NAME: ethyl (3R)-1-[[2-(cyclopentoxy)-4-pyridyl]methylsulfamoyl]piperidine-3-carboxylate
CAS Name: (3R)-1-[(2-cyclopentyloxy-4-pyridinyl)methylsulfamoyl]-3-piperidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (3R)-1-[(2-cyclopentyloxypyridin-4-yl)methylsulfamoyl]piperidine-3-carboxylate
SYSTEMATIC NAME: ethyl (3R)-1-[(2-cyclopentyloxypyridin-4-yl)methylsulfamoyl]piperidine-3-carboxylate
MOLECULAR FORMULA: C19H29N3O5S
MOLECULAR WEIGHT: 411.51566
SMILES: CCOC(=O)[C@@H]1CCCN(C1)S(=O)(=O)NCC2=CC(=NC=C2)OC3CCCC3
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Product OPENEYE NAME: ethyl (3S)-1-[[2-(cyclopentoxy)-4-pyridyl]methylsulfamoyl]piperidine-3-carboxylate
CAS Name: (3S)-1-[(2-cyclopentyloxy-4-pyridinyl)methylsulfamoyl]-3-piperidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (3S)-1-[(2-cyclopentyloxypyridin-4-yl)methylsulfamoyl]piperidine-3-carboxylate
SYSTEMATIC NAME: ethyl (3S)-1-[(2-cyclopentyloxypyridin-4-yl)methylsulfamoyl]piperidine-3-carboxylate
MOLECULAR FORMULA: C19H29N3O5S
MOLECULAR WEIGHT: 411.51566
SMILES: CCOC(=O)[C@H]1CCCN(C1)S(=O)(=O)NCC2=CC(=NC=C2)OC3CCCC3
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