Monday, February 27, 2012

All Chemical Compounds Information




Product OPENEYE NAME: N'-(2-furylmethyleneamino)-4-hydroxy-3-imino-quinoxaline-2-carboxamidine
CAS Name: N'-(2-furanylmethylideneamino)-4-hydroxy-3-imino-2-quinoxalinecarboximidamide
IUPAC NAME: N'-(furan-2-ylmethylideneamino)-4-hydroxy-3-iminoquinoxaline-2-carboximidamide
SYSTEMATIC NAME: 3-azanylidene-N'-(furan-2-ylmethylideneamino)-4-oxidanyl-quinoxaline-2-carboximidamide
MOLECULAR FORMULA: C14H12N6O2
MOLECULAR WEIGHT: 296.28408
SMILES: C1=CC=C2C(=C1)N=C(C(=N)N2O)C(=NN=CC3=CC=CO3)N
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Product OPENEYE NAME: 2-cyano-N-[2-(1H-indol-3-yl)ethyl]-3-(3-iodo-4,5-dimethoxy-phenyl)prop-2-enamide
CAS Name: 2-cyano-N-[2-(1H-indol-3-yl)ethyl]-3-(3-iodo-4,5-dimethoxyphenyl)-2-propenamide
IUPAC NAME: 2-cyano-N-[2-(1H-indol-3-yl)ethyl]-3-(3-iodo-4,5-dimethoxyphenyl)prop-2-enamide
SYSTEMATIC NAME: 2-cyano-N-[2-(1H-indol-3-yl)ethyl]-3-(3-iodanyl-4,5-dimethoxy-phenyl)prop-2-enamide
MOLECULAR FORMULA: C22H20IN3O3
MOLECULAR WEIGHT: 501.31697
SMILES: COC1=C(C(=CC(=C1)C=C(C#N)C(=O)NCCC2=CNC3=CC=CC=C32)I)OC
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Product OPENEYE NAME: 2-(4-chlorophenyl)-7-methyl-indolizine-3-carbaldehyde
CAS Name: 2-(4-chlorophenyl)-7-methyl-3-indolizinecarboxaldehyde
IUPAC NAME: 2-(4-chlorophenyl)-7-methylindolizine-3-carbaldehyde
SYSTEMATIC NAME: 2-(4-chlorophenyl)-7-methyl-indolizine-3-carbaldehyde
MOLECULAR FORMULA: C16H12ClNO
MOLECULAR WEIGHT: 269.72558
SMILES: CC1=CC2=CC(=C(N2C=C1)C=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 5-(4-cyanophenyl)furan-2-carboxylic acid
CAS Name: 5-(4-cyanophenyl)-2-furancarboxylic acid
IUPAC NAME: 5-(4-cyanophenyl)furan-2-carboxylic acid
SYSTEMATIC NAME: 5-(4-cyanophenyl)furan-2-carboxylic acid
MOLECULAR FORMULA: C12H7NO3
MOLECULAR WEIGHT: 213.18888
SMILES: C1=CC(=CC=C1C#N)C2=CC=C(O2)C(=O)O
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Product OPENEYE NAME: 5-(3-cyanophenyl)furan-2-carboxylic acid
CAS Name: 5-(3-cyanophenyl)-2-furancarboxylic acid
IUPAC NAME: 5-(3-cyanophenyl)furan-2-carboxylic acid
SYSTEMATIC NAME: 5-(3-cyanophenyl)furan-2-carboxylic acid
MOLECULAR FORMULA: C12H7NO3
MOLECULAR WEIGHT: 213.18888
SMILES: C1=CC(=CC(=C1)C2=CC=C(O2)C(=O)O)C#N
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Product OPENEYE NAME: 5-(benzothiophen-3-yl)furan-2-carboxylic acid
CAS Name: 5-(1-benzothiophen-3-yl)-2-furancarboxylic acid
IUPAC NAME: 5-(1-benzothiophen-3-yl)furan-2-carboxylic acid
SYSTEMATIC NAME: 5-(1-benzothiophen-3-yl)furan-2-carboxylic acid
MOLECULAR FORMULA: C13H8O3S
MOLECULAR WEIGHT: 244.26582
SMILES: C1=CC=C2C(=C1)C(=CS2)C3=CC=C(O3)C(=O)O
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Product OPENEYE NAME: 3-(3-chlorophenyl)benzonitrile
CAS Name: 3-(3-chlorophenyl)benzonitrile
IUPAC NAME: 3-(3-chlorophenyl)benzonitrile
SYSTEMATIC NAME: 3-(3-chlorophenyl)benzenecarbonitrile
MOLECULAR FORMULA: C13H8ClN
MOLECULAR WEIGHT: 213.66232
SMILES: C1=CC(=CC(=C1)C2=CC(=CC=C2)Cl)C#N
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Product OPENEYE NAME: 3-(2-methoxyphenyl)benzonitrile
CAS Name: 3-(2-methoxyphenyl)benzonitrile
IUPAC NAME: 3-(2-methoxyphenyl)benzonitrile
SYSTEMATIC NAME: 3-(2-methoxyphenyl)benzenecarbonitrile
MOLECULAR FORMULA: C14H11NO
MOLECULAR WEIGHT: 209.24324
SMILES: COC1=CC=CC=C1C2=CC=CC(=C2)C#N
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Product OPENEYE NAME: 3-(3-methoxyphenyl)benzonitrile
CAS Name: 3-(3-methoxyphenyl)benzonitrile
IUPAC NAME: 3-(3-methoxyphenyl)benzonitrile
SYSTEMATIC NAME: 3-(3-methoxyphenyl)benzenecarbonitrile
MOLECULAR FORMULA: C14H11NO
MOLECULAR WEIGHT: 209.24324
SMILES: COC1=CC=CC(=C1)C2=CC=CC(=C2)C#N
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Product OPENEYE NAME: N-[2-[1,3-benzodioxol-5-ylmethyl(2-thienylmethyl)amino]-2-oxo-ethyl]-2,2-dichloro-N-isopropyl-acetamide
CAS Name: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-2,2-dichloro-N-propan-2-ylacetamide
IUPAC NAME: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-2,2-dichloro-N-propan-2-ylacetamide
SYSTEMATIC NAME: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-2,2-bis(chloranyl)-N-propan-2-yl-ethanamide
MOLECULAR FORMULA: C20H22Cl2N2O4S
MOLECULAR WEIGHT: 457.37068
SMILES: CC(C)N(CC(=O)N(CC1=CC2=C(C=C1)OCO2)CC3=CC=CS3)C(=O)C(Cl)Cl
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Product OPENEYE NAME: N-[2-[(4-fluorophenyl)methyl-(2-thienylmethyl)amino]-2-oxo-ethyl]-N-(2-morpholinoethyl)decanamide
CAS Name: N-[2-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-2-oxoethyl]-N-[2-(4-morpholinyl)ethyl]decanamide
IUPAC NAME: N-[2-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-2-oxoethyl]-N-(2-morpholin-4-ylethyl)decanamide
SYSTEMATIC NAME: N-[2-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-N-(2-morpholin-4-ylethyl)decanamide
MOLECULAR FORMULA: C30H44FN3O3S
MOLECULAR WEIGHT: 545.752063
SMILES: CCCCCCCCCC(=O)N(CCN1CCOCC1)CC(=O)N(CC2=CC=C(C=C2)F)CC3=CC=CS3
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Product OPENEYE NAME: ethyl 4-[[2-[2-(3,4-dimethoxyphenyl)ethyl-[(3-methyl-2-thienyl)methyl]amino]-2-oxo-ethyl]-(2-methoxyethyl)amino]-4-oxo-butanoate
CAS Name: 4-[[2-[2-(3,4-dimethoxyphenyl)ethyl-[(3-methyl-2-thiophenyl)methyl]amino]-2-oxoethyl]-(2-methoxyethyl)amino]-4-oxobutanoic acid ethyl ester
IUPAC NAME: ethyl 4-[[2-[2-(3,4-dimethoxyphenyl)ethyl-[(3-methylthiophen-2-yl)methyl]amino]-2-oxoethyl]-(2-methoxyethyl)amino]-4-oxobutanoate
SYSTEMATIC NAME: ethyl 4-[[2-[2-(3,4-dimethoxyphenyl)ethyl-[(3-methylthiophen-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-(2-methoxyethyl)amino]-4-oxidanylidene-butanoate
MOLECULAR FORMULA: C27H38N2O7S
MOLECULAR WEIGHT: 534.66482
SMILES: CCOC(=O)CCC(=O)N(CCOC)CC(=O)N(CCC1=CC(=C(C=C1)OC)OC)CC2=C(C=CS2)C
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Product OPENEYE NAME: N-cyclohexyl-N-[2-[(4-fluorophenyl)methyl-[(3-methyl-2-thienyl)methyl]amino]-2-oxo-ethyl]heptanamide
CAS Name: N-cyclohexyl-N-[2-[(4-fluorophenyl)methyl-[(3-methyl-2-thiophenyl)methyl]amino]-2-oxoethyl]heptanamide
IUPAC NAME: N-cyclohexyl-N-[2-[(4-fluorophenyl)methyl-[(3-methylthiophen-2-yl)methyl]amino]-2-oxoethyl]heptanamide
SYSTEMATIC NAME: N-cyclohexyl-N-[2-[(4-fluorophenyl)methyl-[(3-methylthiophen-2-yl)methyl]amino]-2-oxidanylidene-ethyl]heptanamide
MOLECULAR FORMULA: C28H39FN2O2S
MOLECULAR WEIGHT: 486.684863
SMILES: CCCCCCC(=O)N(CC(=O)N(CC1=CC=C(C=C1)F)CC2=C(C=CS2)C)C3CCCCC3
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Product OPENEYE NAME: N-[2-[benzyl-[(3-methyl-2-thienyl)methyl]amino]-2-oxo-ethyl]-2,4-dimethoxy-N-propyl-benzamide
CAS Name: 2,4-dimethoxy-N-[2-[(3-methyl-2-thiophenyl)methyl-(phenylmethyl)amino]-2-oxoethyl]-N-propylbenzamide
IUPAC NAME: N-[2-[benzyl-[(3-methylthiophen-2-yl)methyl]amino]-2-oxoethyl]-2,4-dimethoxy-N-propylbenzamide
SYSTEMATIC NAME: 2,4-dimethoxy-N-[2-[(3-methylthiophen-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-N-propyl-benzamide
MOLECULAR FORMULA: C27H32N2O4S
MOLECULAR WEIGHT: 480.61898
SMILES: CCCN(CC(=O)N(CC1=CC=CC=C1)CC2=C(C=CS2)C)C(=O)C3=C(C=C(C=C3)OC)OC
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Product OPENEYE NAME: N-[(4-fluorophenyl)methyl]-2-[isobutyl(m-tolylcarbamoyl)amino]-N-[(3-methyl-2-thienyl)methyl]acetamide
CAS Name: N-[(4-fluorophenyl)methyl]-2-[[(3-methylanilino)-oxomethyl]-(2-methylpropyl)amino]-N-[(3-methyl-2-thiophenyl)methyl]acetamide
IUPAC NAME: N-[(4-fluorophenyl)methyl]-2-[(3-methylphenyl)carbamoyl-(2-methylpropyl)amino]-N-[(3-methylthiophen-2-yl)methyl]acetamide
SYSTEMATIC NAME: N-[(4-fluorophenyl)methyl]-2-[(3-methylphenyl)carbamoyl-(2-methylpropyl)amino]-N-[(3-methylthiophen-2-yl)methyl]ethanamide
MOLECULAR FORMULA: C27H32FN3O2S
MOLECULAR WEIGHT: 481.625283
SMILES: CC1=CC(=CC=C1)NC(=O)N(CC(C)C)CC(=O)N(CC2=CC=C(C=C2)F)CC3=C(C=CS3)C
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Product OPENEYE NAME: N-benzyl-2-[(3-cyanophenyl)carbamoyl-(2-methoxyethyl)amino]-N-[(3-methyl-2-thienyl)methyl]acetamide
CAS Name: 2-[[(3-cyanoanilino)-oxomethyl]-(2-methoxyethyl)amino]-N-[(3-methyl-2-thiophenyl)methyl]-N-(phenylmethyl)acetamide
IUPAC NAME: N-benzyl-2-[(3-cyanophenyl)carbamoyl-(2-methoxyethyl)amino]-N-[(3-methylthiophen-2-yl)methyl]acetamide
SYSTEMATIC NAME: 2-[(3-cyanophenyl)carbamoyl-(2-methoxyethyl)amino]-N-[(3-methylthiophen-2-yl)methyl]-N-(phenylmethyl)ethanamide
MOLECULAR FORMULA: C26H28N4O3S
MOLECULAR WEIGHT: 476.59052
SMILES: CC1=C(SC=C1)CN(CC2=CC=CC=C2)C(=O)CN(CCOC)C(=O)NC3=CC=CC(=C3)C#N
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Product OPENEYE NAME: 2-chloro-N-[2-[2-(1H-indol-3-yl)ethyl-[[4-(trifluoromethyl)phenyl]methyl]amino]-2-oxo-ethyl]-N-isobutyl-propanamide
CAS Name: 2-chloro-N-[2-[2-(1H-indol-3-yl)ethyl-[[4-(trifluoromethyl)phenyl]methyl]amino]-2-oxoethyl]-N-(2-methylpropyl)propanamide
IUPAC NAME: 2-chloro-N-[2-[2-(1H-indol-3-yl)ethyl-[[4-(trifluoromethyl)phenyl]methyl]amino]-2-oxoethyl]-N-(2-methylpropyl)propanamide
SYSTEMATIC NAME: 2-chloranyl-N-[2-[2-(1H-indol-3-yl)ethyl-[[4-(trifluoromethyl)phenyl]methyl]amino]-2-oxidanylidene-ethyl]-N-(2-methylpropyl)propanamide
MOLECULAR FORMULA: C27H31ClF3N3O2
MOLECULAR WEIGHT: 522.00215
SMILES: CC(C)CN(CC(=O)N(CCC1=CNC2=CC=CC=C21)CC3=CC=C(C=C3)C(F)(F)F)C(=O)C(C)Cl
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Product OPENEYE NAME: 2-[(2-fluorophenyl)carbamoyl-(2-methoxyethyl)amino]-N-[2-(1H-indol-3-yl)ethyl]-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide
CAS Name: 2-[[(2-fluoroanilino)-oxomethyl]-(2-methoxyethyl)amino]-N-[2-(1H-indol-3-yl)ethyl]-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide
IUPAC NAME: 2-[(2-fluorophenyl)carbamoyl-(2-methoxyethyl)amino]-N-[2-(1H-indol-3-yl)ethyl]-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide
SYSTEMATIC NAME: 2-[(2-fluorophenyl)carbamoyl-(2-methoxyethyl)amino]-N-[2-(1H-indol-3-yl)ethyl]-N-[[4-(trifluoromethyl)phenyl]methyl]ethanamide
MOLECULAR FORMULA: C30H30F4N4O3
MOLECULAR WEIGHT: 570.577813
SMILES: COCCN(CC(=O)N(CCC1=CNC2=CC=CC=C21)CC3=CC=C(C=C3)C(F)(F)F)C(=O)NC4=CC=CC=C4F
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Product OPENEYE NAME: N-[2-[(4-fluorophenyl)methyl-[(5-methyl-2-furyl)methyl]amino]-2-oxo-ethyl]-4-hexyl-N-(2-morpholinoethyl)benzamide
CAS Name: N-[2-[(4-fluorophenyl)methyl-[(5-methyl-2-furanyl)methyl]amino]-2-oxoethyl]-4-hexyl-N-[2-(4-morpholinyl)ethyl]benzamide
IUPAC NAME: N-[2-[(4-fluorophenyl)methyl-[(5-methylfuran-2-yl)methyl]amino]-2-oxoethyl]-4-hexyl-N-(2-morpholin-4-ylethyl)benzamide
SYSTEMATIC NAME: N-[2-[(4-fluorophenyl)methyl-[(5-methylfuran-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-4-hexyl-N-(2-morpholin-4-ylethyl)benzamide
MOLECULAR FORMULA: C34H44FN3O4
MOLECULAR WEIGHT: 577.729263
SMILES: CCCCCCC1=CC=C(C=C1)C(=O)N(CCN2CCOCC2)CC(=O)N(CC3=CC=C(C=C3)F)CC4=CC=C(O4)C
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Product OPENEYE NAME: N-[2-[1,3-benzodioxol-5-ylmethyl-[(5-methyl-2-furyl)methyl]amino]-2-oxo-ethyl]-N-(3-ethoxypropyl)-3-methoxy-benzamide
CAS Name: N-[2-[1,3-benzodioxol-5-ylmethyl-[(5-methyl-2-furanyl)methyl]amino]-2-oxoethyl]-N-(3-ethoxypropyl)-3-methoxybenzamide
IUPAC NAME: N-[2-[1,3-benzodioxol-5-ylmethyl-[(5-methylfuran-2-yl)methyl]amino]-2-oxoethyl]-N-(3-ethoxypropyl)-3-methoxybenzamide
SYSTEMATIC NAME: N-[2-[1,3-benzodioxol-5-ylmethyl-[(5-methylfuran-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-N-(3-ethoxypropyl)-3-methoxy-benzamide
MOLECULAR FORMULA: C29H34N2O7
MOLECULAR WEIGHT: 522.58946
SMILES: CCOCCCN(CC(=O)N(CC1=CC2=C(C=C1)OCO2)CC3=CC=C(O3)C)C(=O)C4=CC(=CC=C4)OC
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Product OPENEYE NAME: N-benzyl-N-(2-furylmethyl)-2-[(3-methoxyphenyl)carbamoyl-propyl-amino]acetamide
CAS Name: N-(2-furanylmethyl)-2-[[(3-methoxyanilino)-oxomethyl]-propylamino]-N-(phenylmethyl)acetamide
IUPAC NAME: N-benzyl-N-(furan-2-ylmethyl)-2-[(3-methoxyphenyl)carbamoyl-propylamino]acetamide
SYSTEMATIC NAME: N-(furan-2-ylmethyl)-2-[(3-methoxyphenyl)carbamoyl-propyl-amino]-N-(phenylmethyl)ethanamide
MOLECULAR FORMULA: C25H29N3O4
MOLECULAR WEIGHT: 435.51546
SMILES: CCCN(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CO2)C(=O)NC3=CC(=CC=C3)OC
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Product OPENEYE NAME: 2-(4-cyanophenyl)-N'-isopropyl-1-methyl-benzimidazole-5-carboxamidine
CAS Name: 2-(4-cyanophenyl)-1-methyl-N'-propan-2-yl-5-benzimidazolecarboximidamide
IUPAC NAME: 2-(4-cyanophenyl)-1-methyl-N'-propan-2-ylbenzimidazole-5-carboximidamide
SYSTEMATIC NAME: 2-(4-cyanophenyl)-1-methyl-N'-propan-2-yl-benzimidazole-5-carboximidamide
MOLECULAR FORMULA: C19H19N5
MOLECULAR WEIGHT: 317.38766
SMILES: CC(C)N=C(C1=CC2=C(C=C1)N(C(=N2)C3=CC=C(C=C3)C#N)C)N
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