Wednesday, January 30, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 2-(3,5-dimethylisoxazol-4-yl)-N-(2-methoxy-1-methyl-ethyl)acetamide
CAS Name: 2-(3,5-dimethyl-4-isoxazolyl)-N-(1-methoxypropan-2-yl)acetamide
IUPAC NAME: 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(1-methoxypropan-2-yl)acetamide
SYSTEMATIC NAME: 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(1-methoxypropan-2-yl)ethanamide
MOLECULAR FORMULA: C11H18N2O3
MOLECULAR WEIGHT: 226.27222
SMILES: CC1=C(C(=NO1)C)CC(=O)NC(C)COC
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Product OPENEYE NAME: N-(2-methoxy-1-methyl-ethyl)-2-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]acetamide
CAS Name: N-(1-methoxypropan-2-yl)-2-[[5-(trifluoromethyl)-2-pyridinyl]thio]acetamide
IUPAC NAME: N-(1-methoxypropan-2-yl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylacetamide
SYSTEMATIC NAME: N-(1-methoxypropan-2-yl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-ethanamide
MOLECULAR FORMULA: C12H15F3N2O2S
MOLECULAR WEIGHT: 308.31991
SMILES: CC(COC)NC(=O)CSC1=NC=C(C=C1)C(F)(F)F
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Product OPENEYE NAME: 3,4-dimethyl-5-(methylsulfamoyl)-N-(2,2,2-trifluoroethyl)benzamide
CAS Name: 3,4-dimethyl-5-(methylsulfamoyl)-N-(2,2,2-trifluoroethyl)benzamide
IUPAC NAME: 3,4-dimethyl-5-(methylsulfamoyl)-N-(2,2,2-trifluoroethyl)benzamide
SYSTEMATIC NAME: 3,4-dimethyl-5-(methylsulfamoyl)-N-[2,2,2-tris(fluoranyl)ethyl]benzamide
MOLECULAR FORMULA: C12H15F3N2O3S
MOLECULAR WEIGHT: 324.31931
SMILES: CC1=C(C(=CC(=C1)C(=O)NCC(F)(F)F)S(=O)(=O)NC)C
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Product OPENEYE NAME: 2-(3,5-dimethylisoxazol-4-yl)-N-[(4-ethylphenyl)methyl]-N-methyl-acetamide
CAS Name: 2-(3,5-dimethyl-4-isoxazolyl)-N-[(4-ethylphenyl)methyl]-N-methylacetamide
IUPAC NAME: 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(4-ethylphenyl)methyl]-N-methylacetamide
SYSTEMATIC NAME: 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(4-ethylphenyl)methyl]-N-methyl-ethanamide
MOLECULAR FORMULA: C17H22N2O2
MOLECULAR WEIGHT: 286.36878
SMILES: CCC1=CC=C(C=C1)CN(C)C(=O)CC2=C(ON=C2C)C
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Product OPENEYE NAME: N-[1-(2,4-dichlorophenyl)ethyl]-2-(3,5-dimethylisoxazol-4-yl)acetamide
CAS Name: N-[1-(2,4-dichlorophenyl)ethyl]-2-(3,5-dimethyl-4-isoxazolyl)acetamide
IUPAC NAME: N-[1-(2,4-dichlorophenyl)ethyl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide
SYSTEMATIC NAME: N-[1-(2,4-dichlorophenyl)ethyl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)ethanamide
MOLECULAR FORMULA: C15H16Cl2N2O2
MOLECULAR WEIGHT: 327.20574
SMILES: CC1=C(C(=NO1)C)CC(=O)NC(C)C2=C(C=C(C=C2)Cl)Cl
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Product OPENEYE NAME: N-[2-(dimethylamino)-2-(2-thienyl)ethyl]-2-(3,5-dimethylisoxazol-4-yl)acetamide
CAS Name: N-[2-(dimethylamino)-2-thiophen-2-ylethyl]-2-(3,5-dimethyl-4-isoxazolyl)acetamide
IUPAC NAME: N-[2-(dimethylamino)-2-thiophen-2-ylethyl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide
SYSTEMATIC NAME: N-[2-(dimethylamino)-2-thiophen-2-yl-ethyl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)ethanamide
MOLECULAR FORMULA: C15H21N3O2S
MOLECULAR WEIGHT: 307.41114
SMILES: CC1=C(C(=NO1)C)CC(=O)NCC(C2=CC=CS2)N(C)C
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Product OPENEYE NAME: N-methyl-3-(4-sulfamoylphenyl)-N-(2-thienylmethyl)propanamide
CAS Name: N-methyl-3-(4-sulfamoylphenyl)-N-(thiophen-2-ylmethyl)propanamide
IUPAC NAME: N-methyl-3-(4-sulfamoylphenyl)-N-(thiophen-2-ylmethyl)propanamide
SYSTEMATIC NAME: N-methyl-3-(4-sulfamoylphenyl)-N-(thiophen-2-ylmethyl)propanamide
MOLECULAR FORMULA: C15H18N2O3S2
MOLECULAR WEIGHT: 338.44502
SMILES: CN(CC1=CC=CS1)C(=O)CCC2=CC=C(C=C2)S(=O)(=O)N
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Product OPENEYE NAME: 2-(3,5-dimethylisoxazol-4-yl)-N-[(4-isopropylphenyl)methyl]-N-methyl-acetamide
CAS Name: 2-(3,5-dimethyl-4-isoxazolyl)-N-methyl-N-[(4-propan-2-ylphenyl)methyl]acetamide
IUPAC NAME: 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-methyl-N-[(4-propan-2-ylphenyl)methyl]acetamide
SYSTEMATIC NAME: 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-methyl-N-[(4-propan-2-ylphenyl)methyl]ethanamide
MOLECULAR FORMULA: C18H24N2O2
MOLECULAR WEIGHT: 300.39536
SMILES: CC1=C(C(=NO1)C)CC(=O)N(C)CC2=CC=C(C=C2)C(C)C
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Product OPENEYE NAME: N-[4-[(3-fluorophenyl)methyl-methyl-amino]-4-oxo-butyl]furan-2-carboxamide
CAS Name: N-[4-[(3-fluorophenyl)methyl-methylamino]-4-oxobutyl]-2-furancarboxamide
IUPAC NAME: N-[4-[(3-fluorophenyl)methyl-methylamino]-4-oxobutyl]furan-2-carboxamide
SYSTEMATIC NAME: N-[4-[(3-fluorophenyl)methyl-methyl-amino]-4-oxidanylidene-butyl]furan-2-carboxamide
MOLECULAR FORMULA: C17H19FN2O3
MOLECULAR WEIGHT: 318.342763
SMILES: CN(CC1=CC(=CC=C1)F)C(=O)CCCNC(=O)C2=CC=CO2
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Product OPENEYE NAME: N-[2-(dimethylamino)-2-(2-furyl)ethyl]-2-(3,5-dimethylisoxazol-4-yl)acetamide
CAS Name: N-[2-(dimethylamino)-2-(2-furanyl)ethyl]-2-(3,5-dimethyl-4-isoxazolyl)acetamide
IUPAC NAME: N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide
SYSTEMATIC NAME: N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)ethanamide
MOLECULAR FORMULA: C15H21N3O3
MOLECULAR WEIGHT: 291.34554
SMILES: CC1=C(C(=NO1)C)CC(=O)NCC(C2=CC=CO2)N(C)C
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Product OPENEYE NAME: N-[2-(dimethylamino)-2-(2-furyl)ethyl]-4-(5-methyl-2-thienyl)-4-oxo-butanamide
CAS Name: N-[2-(dimethylamino)-2-(2-furanyl)ethyl]-4-(5-methyl-2-thiophenyl)-4-oxobutanamide
IUPAC NAME: N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-4-(5-methylthiophen-2-yl)-4-oxobutanamide
SYSTEMATIC NAME: N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-4-(5-methylthiophen-2-yl)-4-oxidanylidene-butanamide
MOLECULAR FORMULA: C17H22N2O3S
MOLECULAR WEIGHT: 334.43318
SMILES: CC1=CC=C(S1)C(=O)CCC(=O)NCC(C2=CC=CO2)N(C)C
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Product OPENEYE NAME: N-(2-phenoxyethyl)-3-(4-sulfamoylphenyl)propanamide
CAS Name: N-(2-phenoxyethyl)-3-(4-sulfamoylphenyl)propanamide
IUPAC NAME: N-(2-phenoxyethyl)-3-(4-sulfamoylphenyl)propanamide
SYSTEMATIC NAME: N-(2-phenoxyethyl)-3-(4-sulfamoylphenyl)propanamide
MOLECULAR FORMULA: C17H20N2O4S
MOLECULAR WEIGHT: 348.4167
SMILES: C1=CC=C(C=C1)OCCNC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N
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Product OPENEYE NAME: 4-[3-oxo-3-(3-oxopiperazin-1-yl)propyl]benzenesulfonamide
CAS Name: 4-[3-oxo-3-(3-oxo-1-piperazinyl)propyl]benzenesulfonamide
IUPAC NAME: 4-[3-oxo-3-(3-oxopiperazin-1-yl)propyl]benzenesulfonamide
SYSTEMATIC NAME: 4-[3-oxidanylidene-3-(3-oxidanylidenepiperazin-1-yl)propyl]benzenesulfonamide
MOLECULAR FORMULA: C13H17N3O4S
MOLECULAR WEIGHT: 311.35678
SMILES: C1CN(CC(=O)N1)C(=O)CCC2=CC=C(C=C2)S(=O)(=O)N
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Product OPENEYE NAME: 2-(3,5-dimethylisoxazol-4-yl)-1-[4-(2-phenoxyethyl)piperazin-1-yl]ethanone
CAS Name: 2-(3,5-dimethyl-4-isoxazolyl)-1-[4-(2-phenoxyethyl)-1-piperazinyl]ethanone
IUPAC NAME: 2-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[4-(2-phenoxyethyl)piperazin-1-yl]ethanone
SYSTEMATIC NAME: 2-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[4-(2-phenoxyethyl)piperazin-1-yl]ethanone
MOLECULAR FORMULA: C19H25N3O3
MOLECULAR WEIGHT: 343.4201
SMILES: CC1=C(C(=NO1)C)CC(=O)N2CCN(CC2)CCOC3=CC=CC=C3
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Product OPENEYE NAME: 3-(4-sulfamoylphenyl)-N-[1-(2-thienyl)ethyl]propanamide
CAS Name: 3-(4-sulfamoylphenyl)-N-(1-thiophen-2-ylethyl)propanamide
IUPAC NAME: 3-(4-sulfamoylphenyl)-N-(1-thiophen-2-ylethyl)propanamide
SYSTEMATIC NAME: 3-(4-sulfamoylphenyl)-N-(1-thiophen-2-ylethyl)propanamide
MOLECULAR FORMULA: C15H18N2O3S2
MOLECULAR WEIGHT: 338.44502
SMILES: CC(C1=CC=CS1)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N
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Product OPENEYE NAME: N-[2-(2-furyl)ethyl]-3-(4-sulfamoylphenyl)propanamide
CAS Name: N-[2-(2-furanyl)ethyl]-3-(4-sulfamoylphenyl)propanamide
IUPAC NAME: N-[2-(furan-2-yl)ethyl]-3-(4-sulfamoylphenyl)propanamide
SYSTEMATIC NAME: N-[2-(furan-2-yl)ethyl]-3-(4-sulfamoylphenyl)propanamide
MOLECULAR FORMULA: C15H18N2O4S
MOLECULAR WEIGHT: 322.37942
SMILES: C1=COC(=C1)CCNC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N
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Product OPENEYE NAME: N-[1-(4-pyridyl)ethyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
CAS Name: N-(1-pyridin-4-ylethyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide
IUPAC NAME: N-(1-pyridin-4-ylethyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
SYSTEMATIC NAME: N-(1-pyridin-4-ylethyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
MOLECULAR FORMULA: C17H18N2O3
MOLECULAR WEIGHT: 298.33642
SMILES: CC(C1=CC=NC=C1)NC(=O)C2=CC3=C(C=C2)OCCCO3
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Product OPENEYE NAME: 1-(2,2-dimethylpropanoyl)-N-[1-(4-pyridyl)ethyl]piperidine-4-carboxamide
CAS Name: 1-(2,2-dimethyl-1-oxopropyl)-N-(1-pyridin-4-ylethyl)-4-piperidinecarboxamide
IUPAC NAME: 1-(2,2-dimethylpropanoyl)-N-(1-pyridin-4-ylethyl)piperidine-4-carboxamide
SYSTEMATIC NAME: 1-(2,2-dimethylpropanoyl)-N-(1-pyridin-4-ylethyl)piperidine-4-carboxamide
MOLECULAR FORMULA: C18H27N3O2
MOLECULAR WEIGHT: 317.42588
SMILES: CC(C1=CC=NC=C1)NC(=O)C2CCN(CC2)C(=O)C(C)(C)C
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Product OPENEYE NAME: N-[[4-(difluoromethoxy)phenyl]methyl]tetrahydrofuran-2-carboxamide
CAS Name: N-[[4-(difluoromethoxy)phenyl]methyl]-2-oxolanecarboxamide
IUPAC NAME: N-[[4-(difluoromethoxy)phenyl]methyl]oxolane-2-carboxamide
SYSTEMATIC NAME: N-[[4-[bis(fluoranyl)methoxy]phenyl]methyl]oxolane-2-carboxamide
MOLECULAR FORMULA: C13H15F2NO3
MOLECULAR WEIGHT: 271.259906
SMILES: C1CC(OC1)C(=O)NCC2=CC=C(C=C2)OC(F)F
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Product OPENEYE NAME: N-[2-(4-methoxyphenoxy)ethyl]-N,2-dimethyl-cyclopropanecarboxamide
CAS Name: N-[2-(4-methoxyphenoxy)ethyl]-N,2-dimethyl-1-cyclopropanecarboxamide
IUPAC NAME: N-[2-(4-methoxyphenoxy)ethyl]-N,2-dimethylcyclopropane-1-carboxamide
SYSTEMATIC NAME: N-[2-(4-methoxyphenoxy)ethyl]-N,2-dimethyl-cyclopropane-1-carboxamide
MOLECULAR FORMULA: C15H21NO3
MOLECULAR WEIGHT: 263.33214
SMILES: CC1CC1C(=O)N(C)CCOC2=CC=C(C=C2)OC
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Product OPENEYE NAME: N-[2-(4-methoxyphenoxy)ethyl]-N-methyl-cyclopropanecarboxamide
CAS Name: N-[2-(4-methoxyphenoxy)ethyl]-N-methylcyclopropanecarboxamide
IUPAC NAME: N-[2-(4-methoxyphenoxy)ethyl]-N-methylcyclopropanecarboxamide
SYSTEMATIC NAME: N-[2-(4-methoxyphenoxy)ethyl]-N-methyl-cyclopropanecarboxamide
MOLECULAR FORMULA: C14H19NO3
MOLECULAR WEIGHT: 249.30556
SMILES: CN(CCOC1=CC=C(C=C1)OC)C(=O)C2CC2
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Product OPENEYE NAME: N-methyl-N-[(3-methyl-2-thienyl)methyl]furan-2-carboxamide
CAS Name: N-methyl-N-[(3-methyl-2-thiophenyl)methyl]-2-furancarboxamide
IUPAC NAME: N-methyl-N-[(3-methylthiophen-2-yl)methyl]furan-2-carboxamide
SYSTEMATIC NAME: N-methyl-N-[(3-methylthiophen-2-yl)methyl]furan-2-carboxamide
MOLECULAR FORMULA: C12H13NO2S
MOLECULAR WEIGHT: 235.30212
SMILES: CC1=C(SC=C1)CN(C)C(=O)C2=CC=CO2
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