Thursday, January 31, 2013

All Chemical Compounds Information




Product OPENEYE NAME: methyl 3-(4-chlorophenyl)-3-(cyclopropanecarbonylamino)propanoate
CAS Name: 3-(4-chlorophenyl)-3-[[cyclopropyl(oxo)methyl]amino]propanoic acid methyl ester
IUPAC NAME: methyl 3-(4-chlorophenyl)-3-(cyclopropanecarbonylamino)propanoate
SYSTEMATIC NAME: methyl 3-(4-chlorophenyl)-3-(cyclopropylcarbonylamino)propanoate
MOLECULAR FORMULA: C14H16ClNO3
MOLECULAR WEIGHT: 281.73474
SMILES: COC(=O)CC(C1=CC=C(C=C1)Cl)NC(=O)C2CC2
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Product OPENEYE NAME: 2-(difluoromethoxy)-N-(3-isopropoxypropyl)benzamide
CAS Name: 2-(difluoromethoxy)-N-(3-propan-2-yloxypropyl)benzamide
IUPAC NAME: 2-(difluoromethoxy)-N-(3-propan-2-yloxypropyl)benzamide
SYSTEMATIC NAME: 2-[bis(fluoranyl)methoxy]-N-(3-propan-2-yloxypropyl)benzamide
MOLECULAR FORMULA: C14H19F2NO3
MOLECULAR WEIGHT: 287.302366
SMILES: CC(C)OCCCNC(=O)C1=CC=CC=C1OC(F)F
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Product OPENEYE NAME: 2-ethoxy-N-[(1-ethylpyrrolidin-2-yl)methyl]benzamide
CAS Name: 2-ethoxy-N-[(1-ethyl-2-pyrrolidinyl)methyl]benzamide
IUPAC NAME: 2-ethoxy-N-[(1-ethylpyrrolidin-2-yl)methyl]benzamide
SYSTEMATIC NAME: 2-ethoxy-N-[(1-ethylpyrrolidin-2-yl)methyl]benzamide
MOLECULAR FORMULA: C16H24N2O2
MOLECULAR WEIGHT: 276.37396
SMILES: CCN1CCCC1CNC(=O)C2=CC=CC=C2OCC
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Product OPENEYE NAME: N-[(1-ethylpyrrolidin-2-yl)methyl]-3-fluoro-benzamide
CAS Name: N-[(1-ethyl-2-pyrrolidinyl)methyl]-3-fluorobenzamide
IUPAC NAME: N-[(1-ethylpyrrolidin-2-yl)methyl]-3-fluorobenzamide
SYSTEMATIC NAME: N-[(1-ethylpyrrolidin-2-yl)methyl]-3-fluoranyl-benzamide
MOLECULAR FORMULA: C14H19FN2O
MOLECULAR WEIGHT: 250.311863
SMILES: CCN1CCCC1CNC(=O)C2=CC(=CC=C2)F
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Product OPENEYE NAME: N-[(1-ethylpyrrolidin-2-yl)methyl]-4-methoxy-benzamide
CAS Name: N-[(1-ethyl-2-pyrrolidinyl)methyl]-4-methoxybenzamide
IUPAC NAME: N-[(1-ethylpyrrolidin-2-yl)methyl]-4-methoxybenzamide
SYSTEMATIC NAME: N-[(1-ethylpyrrolidin-2-yl)methyl]-4-methoxy-benzamide
MOLECULAR FORMULA: C15H22N2O2
MOLECULAR WEIGHT: 262.34738
SMILES: CCN1CCCC1CNC(=O)C2=CC=C(C=C2)OC
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Product OPENEYE NAME: N-[(1-ethylpyrrolidin-2-yl)methyl]-2-methyl-benzamide
CAS Name: N-[(1-ethyl-2-pyrrolidinyl)methyl]-2-methylbenzamide
IUPAC NAME: N-[(1-ethylpyrrolidin-2-yl)methyl]-2-methylbenzamide
SYSTEMATIC NAME: N-[(1-ethylpyrrolidin-2-yl)methyl]-2-methyl-benzamide
MOLECULAR FORMULA: C15H22N2O
MOLECULAR WEIGHT: 246.34798
SMILES: CCN1CCCC1CNC(=O)C2=CC=CC=C2C
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Product OPENEYE NAME: N-[(1-ethylpyrrolidin-2-yl)methyl]-2,4-dimethoxy-benzamide
CAS Name: N-[(1-ethyl-2-pyrrolidinyl)methyl]-2,4-dimethoxybenzamide
IUPAC NAME: N-[(1-ethylpyrrolidin-2-yl)methyl]-2,4-dimethoxybenzamide
SYSTEMATIC NAME: N-[(1-ethylpyrrolidin-2-yl)methyl]-2,4-dimethoxy-benzamide
MOLECULAR FORMULA: C16H24N2O3
MOLECULAR WEIGHT: 292.37336
SMILES: CCN1CCCC1CNC(=O)C2=C(C=C(C=C2)OC)OC
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Product OPENEYE NAME: N-[(1-ethylpyrrolidin-2-yl)methyl]-3,5-dimethoxy-benzamide
CAS Name: N-[(1-ethyl-2-pyrrolidinyl)methyl]-3,5-dimethoxybenzamide
IUPAC NAME: N-[(1-ethylpyrrolidin-2-yl)methyl]-3,5-dimethoxybenzamide
SYSTEMATIC NAME: N-[(1-ethylpyrrolidin-2-yl)methyl]-3,5-dimethoxy-benzamide
MOLECULAR FORMULA: C16H24N2O3
MOLECULAR WEIGHT: 292.37336
SMILES: CCN1CCCC1CNC(=O)C2=CC(=CC(=C2)OC)OC
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Product OPENEYE NAME: N-[(1-ethylpyrrolidin-2-yl)methyl]-3,4-dimethoxy-benzamide
CAS Name: N-[(1-ethyl-2-pyrrolidinyl)methyl]-3,4-dimethoxybenzamide
IUPAC NAME: N-[(1-ethylpyrrolidin-2-yl)methyl]-3,4-dimethoxybenzamide
SYSTEMATIC NAME: N-[(1-ethylpyrrolidin-2-yl)methyl]-3,4-dimethoxy-benzamide
MOLECULAR FORMULA: C16H24N2O3
MOLECULAR WEIGHT: 292.37336
SMILES: CCN1CCCC1CNC(=O)C2=CC(=C(C=C2)OC)OC
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Product OPENEYE NAME: N-[(1-ethylpyrrolidin-2-yl)methyl]-3-methyl-benzamide
CAS Name: N-[(1-ethyl-2-pyrrolidinyl)methyl]-3-methylbenzamide
IUPAC NAME: N-[(1-ethylpyrrolidin-2-yl)methyl]-3-methylbenzamide
SYSTEMATIC NAME: N-[(1-ethylpyrrolidin-2-yl)methyl]-3-methyl-benzamide
MOLECULAR FORMULA: C15H22N2O
MOLECULAR WEIGHT: 246.34798
SMILES: CCN1CCCC1CNC(=O)C2=CC(=CC=C2)C
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Product OPENEYE NAME: N-[(1-ethylpyrrolidin-2-yl)methyl]-2-(2-fluorophenyl)acetamide
CAS Name: N-[(1-ethyl-2-pyrrolidinyl)methyl]-2-(2-fluorophenyl)acetamide
IUPAC NAME: N-[(1-ethylpyrrolidin-2-yl)methyl]-2-(2-fluorophenyl)acetamide
SYSTEMATIC NAME: N-[(1-ethylpyrrolidin-2-yl)methyl]-2-(2-fluorophenyl)ethanamide
MOLECULAR FORMULA: C15H21FN2O
MOLECULAR WEIGHT: 264.338443
SMILES: CCN1CCCC1CNC(=O)CC2=CC=CC=C2F
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Product OPENEYE NAME: N-[(1-ethylpyrrolidin-2-yl)methyl]-2-fluoro-benzamide
CAS Name: N-[(1-ethyl-2-pyrrolidinyl)methyl]-2-fluorobenzamide
IUPAC NAME: N-[(1-ethylpyrrolidin-2-yl)methyl]-2-fluorobenzamide
SYSTEMATIC NAME: N-[(1-ethylpyrrolidin-2-yl)methyl]-2-fluoranyl-benzamide
MOLECULAR FORMULA: C14H19FN2O
MOLECULAR WEIGHT: 250.311863
SMILES: CCN1CCCC1CNC(=O)C2=CC=CC=C2F
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Product OPENEYE NAME: methyl 2-[2-(2-phenylbutanoylamino)thiazol-4-yl]acetate
CAS Name: 2-[2-[(1-oxo-2-phenylbutyl)amino]-4-thiazolyl]acetic acid methyl ester
IUPAC NAME: methyl 2-[2-(2-phenylbutanoylamino)-1,3-thiazol-4-yl]acetate
SYSTEMATIC NAME: methyl 2-[2-(2-phenylbutanoylamino)-1,3-thiazol-4-yl]ethanoate
MOLECULAR FORMULA: C16H18N2O3S
MOLECULAR WEIGHT: 318.39072
SMILES: CCC(C1=CC=CC=C1)C(=O)NC2=NC(=CS2)CC(=O)OC
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Product OPENEYE NAME: methyl 2-[2-(3-phenylbutanoylamino)thiazol-4-yl]acetate
CAS Name: 2-[2-[(1-oxo-3-phenylbutyl)amino]-4-thiazolyl]acetic acid methyl ester
IUPAC NAME: methyl 2-[2-(3-phenylbutanoylamino)-1,3-thiazol-4-yl]acetate
SYSTEMATIC NAME: methyl 2-[2-(3-phenylbutanoylamino)-1,3-thiazol-4-yl]ethanoate
MOLECULAR FORMULA: C16H18N2O3S
MOLECULAR WEIGHT: 318.39072
SMILES: CC(CC(=O)NC1=NC(=CS1)CC(=O)OC)C2=CC=CC=C2
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Product OPENEYE NAME: methyl 2-[2-(2-phenoxybutanoylamino)thiazol-4-yl]acetate
CAS Name: 2-[2-[(1-oxo-2-phenoxybutyl)amino]-4-thiazolyl]acetic acid methyl ester
IUPAC NAME: methyl 2-[2-(2-phenoxybutanoylamino)-1,3-thiazol-4-yl]acetate
SYSTEMATIC NAME: methyl 2-[2-(2-phenoxybutanoylamino)-1,3-thiazol-4-yl]ethanoate
MOLECULAR FORMULA: C16H18N2O4S
MOLECULAR WEIGHT: 334.39012
SMILES: CCC(C(=O)NC1=NC(=CS1)CC(=O)OC)OC2=CC=CC=C2
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Product OPENEYE NAME: N-[2-(diisopropylamino)ethyl]-2,3-dimethoxy-benzamide
CAS Name: N-[2-[di(propan-2-yl)amino]ethyl]-2,3-dimethoxybenzamide
IUPAC NAME: N-[2-[di(propan-2-yl)amino]ethyl]-2,3-dimethoxybenzamide
SYSTEMATIC NAME: N-[2-[di(propan-2-yl)amino]ethyl]-2,3-dimethoxy-benzamide
MOLECULAR FORMULA: C17H28N2O3
MOLECULAR WEIGHT: 308.41582
SMILES: CC(C)N(CCNC(=O)C1=C(C(=CC=C1)OC)OC)C(C)C
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Product OPENEYE NAME: N-[2-(diisopropylamino)ethyl]-2,5-dimethyl-furan-3-carboxamide
CAS Name: N-[2-[di(propan-2-yl)amino]ethyl]-2,5-dimethyl-3-furancarboxamide
IUPAC NAME: N-[2-[di(propan-2-yl)amino]ethyl]-2,5-dimethylfuran-3-carboxamide
SYSTEMATIC NAME: N-[2-[di(propan-2-yl)amino]ethyl]-2,5-dimethyl-furan-3-carboxamide
MOLECULAR FORMULA: C15H26N2O2
MOLECULAR WEIGHT: 266.37914
SMILES: CC1=CC(=C(O1)C)C(=O)NCCN(C(C)C)C(C)C
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Product OPENEYE NAME: 3,5-dimethyl-N-(2,2,2-trifluoroethyl)isoxazole-4-carboxamide
CAS Name: 3,5-dimethyl-N-(2,2,2-trifluoroethyl)-4-isoxazolecarboxamide
IUPAC NAME: 3,5-dimethyl-N-(2,2,2-trifluoroethyl)-1,2-oxazole-4-carboxamide
SYSTEMATIC NAME: 3,5-dimethyl-N-[2,2,2-tris(fluoranyl)ethyl]-1,2-oxazole-4-carboxamide
MOLECULAR FORMULA: C8H9F3N2O2
MOLECULAR WEIGHT: 222.16447
SMILES: CC1=C(C(=NO1)C)C(=O)NCC(F)(F)F
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Product OPENEYE NAME: methyl 1-[1-(4-chlorophenyl)cyclopropanecarbonyl]piperidine-4-carboxylate
CAS Name: 1-[[1-(4-chlorophenyl)cyclopropyl]-oxomethyl]-4-piperidinecarboxylic acid methyl ester
IUPAC NAME: methyl 1-[1-(4-chlorophenyl)cyclopropanecarbonyl]piperidine-4-carboxylate
SYSTEMATIC NAME: methyl 1-[1-(4-chlorophenyl)cyclopropyl]carbonylpiperidine-4-carboxylate
MOLECULAR FORMULA: C17H20ClNO3
MOLECULAR WEIGHT: 321.7986
SMILES: COC(=O)C1CCN(CC1)C(=O)C2(CC2)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: N-(4-methyl-2,5-dioxo-4-phenyl-imidazolidin-1-yl)-2-oxo-1H-pyridine-3-carboxamide
CAS Name: N-(4-methyl-2,5-dioxo-4-phenyl-1-imidazolidinyl)-2-oxo-1H-pyridine-3-carboxamide
IUPAC NAME: N-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-2-oxo-1H-pyridine-3-carboxamide
SYSTEMATIC NAME: N-[4-methyl-2,5-bis(oxidanylidene)-4-phenyl-imidazolidin-1-yl]-2-oxidanylidene-1H-pyridine-3-carboxamide
MOLECULAR FORMULA: C16H14N4O4
MOLECULAR WEIGHT: 326.30676
SMILES: CC1(C(=O)N(C(=O)N1)NC(=O)C2=CC=CNC2=O)C3=CC=CC=C3
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Product OPENEYE NAME: N-[2-morpholino-2-(2-thienyl)ethyl]-6-oxo-1H-pyridazine-3-carboxamide
CAS Name: N-[2-(4-morpholinyl)-2-thiophen-2-ylethyl]-6-oxo-1H-pyridazine-3-carboxamide
IUPAC NAME: N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-6-oxo-1H-pyridazine-3-carboxamide
SYSTEMATIC NAME: N-(2-morpholin-4-yl-2-thiophen-2-yl-ethyl)-6-oxidanylidene-1H-pyridazine-3-carboxamide
MOLECULAR FORMULA: C15H18N4O3S
MOLECULAR WEIGHT: 334.39342
SMILES: C1COCCN1C(CNC(=O)C2=NNC(=O)C=C2)C3=CC=CS3
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Product OPENEYE NAME: 3,5-dimethyl-N-[2-morpholino-2-(2-thienyl)ethyl]isoxazole-4-carboxamide
CAS Name: 3,5-dimethyl-N-[2-(4-morpholinyl)-2-thiophen-2-ylethyl]-4-isoxazolecarboxamide
IUPAC NAME: 3,5-dimethyl-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-1,2-oxazole-4-carboxamide
SYSTEMATIC NAME: 3,5-dimethyl-N-(2-morpholin-4-yl-2-thiophen-2-yl-ethyl)-1,2-oxazole-4-carboxamide
MOLECULAR FORMULA: C16H21N3O3S
MOLECULAR WEIGHT: 335.42124
SMILES: CC1=C(C(=NO1)C)C(=O)NCC(C2=CC=CS2)N3CCOCC3
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Product OPENEYE NAME: N-[2-[(4-tert-butylthiazol-2-yl)amino]-2-oxo-ethyl]thiophene-2-carboxamide
CAS Name: N-[2-[(4-tert-butyl-2-thiazolyl)amino]-2-oxoethyl]-2-thiophenecarboxamide
IUPAC NAME: N-[2-[(4-tert-butyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]thiophene-2-carboxamide
SYSTEMATIC NAME: N-[2-[(4-tert-butyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]thiophene-2-carboxamide
MOLECULAR FORMULA: C14H17N3O2S2
MOLECULAR WEIGHT: 323.43368
SMILES: CC(C)(C)C1=CSC(=N1)NC(=O)CNC(=O)C2=CC=CS2
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