Monday, April 30, 2012

All Chemical Compounds Information




Product OPENEYE NAME: [(3R)-1-(4-chlorophenyl)sulfonyl-3-piperidyl]-(4-methyl-1-piperidyl)methanone
CAS Name: [(3R)-1-(4-chlorophenyl)sulfonyl-3-piperidinyl]-(4-methyl-1-piperidinyl)methanone
IUPAC NAME: [(3R)-1-(4-chlorophenyl)sulfonylpiperidin-3-yl]-(4-methylpiperidin-1-yl)methanone
SYSTEMATIC NAME: [(3R)-1-(4-chlorophenyl)sulfonylpiperidin-3-yl]-(4-methylpiperidin-1-yl)methanone
MOLECULAR FORMULA: C18H25ClN2O3S
MOLECULAR WEIGHT: 384.9207
SMILES: CC1CCN(CC1)C(=O)[C@@H]2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: methyl 2-[4-(azepan-1-ylsulfonyl)-2-chloro-phenoxy]acetate
CAS Name: 2-[4-(1-azepanylsulfonyl)-2-chlorophenoxy]acetic acid methyl ester
IUPAC NAME: methyl 2-[4-(azepan-1-ylsulfonyl)-2-chlorophenoxy]acetate
SYSTEMATIC NAME: methyl 2-[4-(azepan-1-ylsulfonyl)-2-chloranyl-phenoxy]ethanoate
MOLECULAR FORMULA: C15H20ClNO5S
MOLECULAR WEIGHT: 361.841
SMILES: COC(=O)COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)Cl
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Product OPENEYE NAME: N-(1,3-benzodioxol-5-ylmethyl)-3-[4-(isopropylsulfamoyl)phenyl]propanamide
CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[4-(propan-2-ylsulfamoyl)phenyl]propanamide
IUPAC NAME: N-(1,3-benzodioxol-5-ylmethyl)-3-[4-(propan-2-ylsulfamoyl)phenyl]propanamide
SYSTEMATIC NAME: N-(1,3-benzodioxol-5-ylmethyl)-3-[4-(propan-2-ylsulfamoyl)phenyl]propanamide
MOLECULAR FORMULA: C20H24N2O5S
MOLECULAR WEIGHT: 404.47996
SMILES: CC(C)NS(=O)(=O)C1=CC=C(C=C1)CCC(=O)NCC2=CC3=C(C=C2)OCO3
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Product OPENEYE NAME: methyl 2-[2-chloro-4-[(4-methyl-1-piperidyl)sulfonyl]phenoxy]acetate
CAS Name: 2-[2-chloro-4-[(4-methyl-1-piperidinyl)sulfonyl]phenoxy]acetic acid methyl ester
IUPAC NAME: methyl 2-[2-chloro-4-(4-methylpiperidin-1-yl)sulfonylphenoxy]acetate
SYSTEMATIC NAME: methyl 2-[2-chloranyl-4-(4-methylpiperidin-1-yl)sulfonyl-phenoxy]ethanoate
MOLECULAR FORMULA: C15H20ClNO5S
MOLECULAR WEIGHT: 361.841
SMILES: CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OCC(=O)OC)Cl
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Product OPENEYE NAME: 4-[3-(azepan-1-yl)-3-oxo-propyl]-N-isopropyl-benzenesulfonamide
CAS Name: 4-[3-(1-azepanyl)-3-oxopropyl]-N-propan-2-ylbenzenesulfonamide
IUPAC NAME: 4-[3-(azepan-1-yl)-3-oxopropyl]-N-propan-2-ylbenzenesulfonamide
SYSTEMATIC NAME: 4-[3-(azepan-1-yl)-3-oxidanylidene-propyl]-N-propan-2-yl-benzenesulfonamide
MOLECULAR FORMULA: C18H28N2O3S
MOLECULAR WEIGHT: 352.49152
SMILES: CC(C)NS(=O)(=O)C1=CC=C(C=C1)CCC(=O)N2CCCCCC2
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Product OPENEYE NAME: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-pyrrolidin-1-ylsulfonylphenoxy)acetamide
CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(1-pyrrolidinylsulfonyl)phenoxy]acetamide
IUPAC NAME: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-pyrrolidin-1-ylsulfonylphenoxy)acetamide
SYSTEMATIC NAME: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-pyrrolidin-1-ylsulfonylphenoxy)ethanamide
MOLECULAR FORMULA: C20H22N2O6S
MOLECULAR WEIGHT: 418.46348
SMILES: C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)OCC(=O)NCC3=CC4=C(C=C3)OCO4
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Product OPENEYE NAME: (3S)-1-(4-chlorophenyl)sulfonyl-N-ethyl-piperidine-3-carboxamide
CAS Name: (3S)-1-(4-chlorophenyl)sulfonyl-N-ethyl-3-piperidinecarboxamide
IUPAC NAME: (3S)-1-(4-chlorophenyl)sulfonyl-N-ethylpiperidine-3-carboxamide
SYSTEMATIC NAME: (3S)-1-(4-chlorophenyl)sulfonyl-N-ethyl-piperidine-3-carboxamide
MOLECULAR FORMULA: C14H19ClN2O3S
MOLECULAR WEIGHT: 330.83026
SMILES: CCNC(=O)[C@H]1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)Cl
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Product OPENEYE NAME: (3R)-1-(4-chlorophenyl)sulfonyl-N-ethyl-piperidine-3-carboxamide
CAS Name: (3R)-1-(4-chlorophenyl)sulfonyl-N-ethyl-3-piperidinecarboxamide
IUPAC NAME: (3R)-1-(4-chlorophenyl)sulfonyl-N-ethylpiperidine-3-carboxamide
SYSTEMATIC NAME: (3R)-1-(4-chlorophenyl)sulfonyl-N-ethyl-piperidine-3-carboxamide
MOLECULAR FORMULA: C14H19ClN2O3S
MOLECULAR WEIGHT: 330.83026
SMILES: CCNC(=O)[C@@H]1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)Cl
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Product OPENEYE NAME: 1-(4-fluorophenyl)sulfonyl-N-(2-methylsulfanylphenyl)piperidine-4-carboxamide
CAS Name: 1-(4-fluorophenyl)sulfonyl-N-[2-(methylthio)phenyl]-4-piperidinecarboxamide
IUPAC NAME: 1-(4-fluorophenyl)sulfonyl-N-(2-methylsulfanylphenyl)piperidine-4-carboxamide
SYSTEMATIC NAME: 1-(4-fluorophenyl)sulfonyl-N-(2-methylsulfanylphenyl)piperidine-4-carboxamide
MOLECULAR FORMULA: C19H21FN2O3S2
MOLECULAR WEIGHT: 408.510043
SMILES: CSC1=CC=CC=C1NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F
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Product OPENEYE NAME: (3S)-1-(3,4-dimethylphenyl)-N-(4-morpholinophenyl)-5-oxo-pyrrolidine-3-carboxamide
CAS Name: (3S)-1-(3,4-dimethylphenyl)-N-[4-(4-morpholinyl)phenyl]-5-oxo-3-pyrrolidinecarboxamide
IUPAC NAME: (3S)-1-(3,4-dimethylphenyl)-N-(4-morpholin-4-ylphenyl)-5-oxopyrrolidine-3-carboxamide
SYSTEMATIC NAME: (3S)-1-(3,4-dimethylphenyl)-N-(4-morpholin-4-ylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide
MOLECULAR FORMULA: C23H27N3O3
MOLECULAR WEIGHT: 393.47878
SMILES: CC1=C(C=C(C=C1)N2C[C@H](CC2=O)C(=O)NC3=CC=C(C=C3)N4CCOCC4)C
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Product OPENEYE NAME: (3R)-1-(3,4-dimethylphenyl)-N-(4-morpholinophenyl)-5-oxo-pyrrolidine-3-carboxamide
CAS Name: (3R)-1-(3,4-dimethylphenyl)-N-[4-(4-morpholinyl)phenyl]-5-oxo-3-pyrrolidinecarboxamide
IUPAC NAME: (3R)-1-(3,4-dimethylphenyl)-N-(4-morpholin-4-ylphenyl)-5-oxopyrrolidine-3-carboxamide
SYSTEMATIC NAME: (3R)-1-(3,4-dimethylphenyl)-N-(4-morpholin-4-ylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide
MOLECULAR FORMULA: C23H27N3O3
MOLECULAR WEIGHT: 393.47878
SMILES: CC1=C(C=C(C=C1)N2C[C@@H](CC2=O)C(=O)NC3=CC=C(C=C3)N4CCOCC4)C
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Product OPENEYE NAME: methyl 2-[2-chloro-4-(2-furylmethylsulfamoyl)phenoxy]acetate
CAS Name: 2-[2-chloro-4-(2-furanylmethylsulfamoyl)phenoxy]acetic acid methyl ester
IUPAC NAME: methyl 2-[2-chloro-4-(furan-2-ylmethylsulfamoyl)phenoxy]acetate
SYSTEMATIC NAME: methyl 2-[2-chloranyl-4-(furan-2-ylmethylsulfamoyl)phenoxy]ethanoate
MOLECULAR FORMULA: C14H14ClNO6S
MOLECULAR WEIGHT: 359.78206
SMILES: COC(=O)COC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC=CO2)Cl
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Product OPENEYE NAME: 2-[2,5-dimethyl-3-(2-nitrovinyl)pyrrol-1-yl]pyridine
CAS Name: 2-[2,5-dimethyl-3-(2-nitroethenyl)-1-pyrrolyl]pyridine
IUPAC NAME: 2-[2,5-dimethyl-3-(2-nitroethenyl)pyrrol-1-yl]pyridine
SYSTEMATIC NAME: 2-[2,5-dimethyl-3-(2-nitroethenyl)pyrrol-1-yl]pyridine
MOLECULAR FORMULA: C13H13N3O2
MOLECULAR WEIGHT: 243.26122
SMILES: CC1=CC(=C(N1C2=CC=CC=N2)C)C=C[N+](=O)[O-]
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Product OPENEYE NAME: 2-[2,5-dimethyl-3-[(E)-2-nitrovinyl]pyrrol-1-yl]pyridine
CAS Name: 2-[2,5-dimethyl-3-[(E)-2-nitroethenyl]-1-pyrrolyl]pyridine
IUPAC NAME: 2-[2,5-dimethyl-3-[(E)-2-nitroethenyl]pyrrol-1-yl]pyridine
SYSTEMATIC NAME: 2-[2,5-dimethyl-3-[(E)-2-nitroethenyl]pyrrol-1-yl]pyridine
MOLECULAR FORMULA: C13H13N3O2
MOLECULAR WEIGHT: 243.26122
SMILES: CC1=CC(=C(N1C2=CC=CC=N2)C)/C=C/[N+](=O)[O-]
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Product OPENEYE NAME: methyl 2-[4-(1,3-benzodioxol-5-ylmethylsulfamoyl)phenoxy]acetate
CAS Name: 2-[4-(1,3-benzodioxol-5-ylmethylsulfamoyl)phenoxy]acetic acid methyl ester
IUPAC NAME: methyl 2-[4-(1,3-benzodioxol-5-ylmethylsulfamoyl)phenoxy]acetate
SYSTEMATIC NAME: methyl 2-[4-(1,3-benzodioxol-5-ylmethylsulfamoyl)phenoxy]ethanoate
MOLECULAR FORMULA: C17H17NO7S
MOLECULAR WEIGHT: 379.38438
SMILES: COC(=O)COC1=CC=C(C=C1)S(=O)(=O)NCC2=CC3=C(C=C2)OCO3
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Product OPENEYE NAME: 3-[4-(cyclohexylsulfamoyl)phenyl]-N-(2-pyridylmethyl)propanamide
CAS Name: 3-[4-(cyclohexylsulfamoyl)phenyl]-N-(2-pyridinylmethyl)propanamide
IUPAC NAME: 3-[4-(cyclohexylsulfamoyl)phenyl]-N-(pyridin-2-ylmethyl)propanamide
SYSTEMATIC NAME: 3-[4-(cyclohexylsulfamoyl)phenyl]-N-(pyridin-2-ylmethyl)propanamide
MOLECULAR FORMULA: C21H27N3O3S
MOLECULAR WEIGHT: 401.52238
SMILES: C1CCC(CC1)NS(=O)(=O)C2=CC=C(C=C2)CCC(=O)NCC3=CC=CC=N3
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Product OPENEYE NAME: N-(2,6-diethylphenyl)-2-(4-pyrrolidin-1-ylsulfonylphenoxy)acetamide
CAS Name: N-(2,6-diethylphenyl)-2-[4-(1-pyrrolidinylsulfonyl)phenoxy]acetamide
IUPAC NAME: N-(2,6-diethylphenyl)-2-(4-pyrrolidin-1-ylsulfonylphenoxy)acetamide
SYSTEMATIC NAME: N-(2,6-diethylphenyl)-2-(4-pyrrolidin-1-ylsulfonylphenoxy)ethanamide
MOLECULAR FORMULA: C22H28N2O4S
MOLECULAR WEIGHT: 416.53372
SMILES: CCC1=C(C(=CC=C1)CC)NC(=O)COC2=CC=C(C=C2)S(=O)(=O)N3CCCC3
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