Wednesday, January 30, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 2-[(3-methyl-1,1-dioxo-thiolan-3-yl)amino]-N-(p-tolyl)propanamide
CAS Name: 2-[(3-methyl-1,1-dioxo-3-thiolanyl)amino]-N-(4-methylphenyl)propanamide
IUPAC NAME: 2-[(3-methyl-1,1-dioxothiolan-3-yl)amino]-N-(4-methylphenyl)propanamide
SYSTEMATIC NAME: 2-[[3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]amino]-N-(4-methylphenyl)propanamide
MOLECULAR FORMULA: C15H22N2O3S
MOLECULAR WEIGHT: 310.41178
SMILES: CC1=CC=C(C=C1)NC(=O)C(C)NC2(CCS(=O)(=O)C2)C
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Product OPENEYE NAME: 2-[(2-propylbenzimidazol-1-yl)methyl]pentanedinitrile
CAS Name: 2-[(2-propyl-1-benzimidazolyl)methyl]pentanedinitrile
IUPAC NAME: 2-[(2-propylbenzimidazol-1-yl)methyl]pentanedinitrile
SYSTEMATIC NAME: 2-[(2-propylbenzimidazol-1-yl)methyl]pentanedinitrile
MOLECULAR FORMULA: C16H18N4
MOLECULAR WEIGHT: 266.34092
SMILES: CCCC1=NC2=CC=CC=C2N1CC(CCC#N)C#N
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Product OPENEYE NAME: methyl 3-[[4-(difluoromethoxy)-3-methoxy-phenyl]methyl-methyl-amino]propanoate
CAS Name: 3-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl-methylamino]propanoic acid methyl ester
IUPAC NAME: methyl 3-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl-methylamino]propanoate
SYSTEMATIC NAME: methyl 3-[[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]methyl-methyl-amino]propanoate
MOLECULAR FORMULA: C14H19F2NO4
MOLECULAR WEIGHT: 303.301766
SMILES: CN(CCC(=O)OC)CC1=CC(=C(C=C1)OC(F)F)OC
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Product OPENEYE NAME: 1-[(2,5-dimethoxyphenyl)methyl]-4-[2-(4-pyridyl)ethyl]piperazine
CAS Name: 1-[(2,5-dimethoxyphenyl)methyl]-4-(2-pyridin-4-ylethyl)piperazine
IUPAC NAME: 1-[(2,5-dimethoxyphenyl)methyl]-4-(2-pyridin-4-ylethyl)piperazine
SYSTEMATIC NAME: 1-[(2,5-dimethoxyphenyl)methyl]-4-(2-pyridin-4-ylethyl)piperazine
MOLECULAR FORMULA: C20H27N3O2
MOLECULAR WEIGHT: 341.44728
SMILES: COC1=CC(=C(C=C1)OC)CN2CCN(CC2)CCC3=CC=NC=C3
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Product OPENEYE NAME: methyl 3-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]propanoate
CAS Name: 3-[4-[(2,5-dimethoxyphenyl)methyl]-1-piperazinyl]propanoic acid methyl ester
IUPAC NAME: methyl 3-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]propanoate
SYSTEMATIC NAME: methyl 3-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]propanoate
MOLECULAR FORMULA: C17H26N2O4
MOLECULAR WEIGHT: 322.39934
SMILES: COC1=CC(=C(C=C1)OC)CN2CCN(CC2)CCC(=O)OC
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Product OPENEYE NAME: 2-[[[2-(2-furyl)-2-(1-piperidyl)ethyl]amino]methyl]pentanedinitrile
CAS Name: 2-[[[2-(2-furanyl)-2-(1-piperidinyl)ethyl]amino]methyl]pentanedinitrile
IUPAC NAME: 2-[[[2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]methyl]pentanedinitrile
SYSTEMATIC NAME: 2-[[[2-(furan-2-yl)-2-piperidin-1-yl-ethyl]amino]methyl]pentanedinitrile
MOLECULAR FORMULA: C17H24N4O
MOLECULAR WEIGHT: 300.39866
SMILES: C1CCN(CC1)C(CNCC(CCC#N)C#N)C2=CC=CO2
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Product OPENEYE NAME: butyl 3-[1-(4-sulfamoylphenyl)ethylamino]propanoate
CAS Name: 3-[1-(4-sulfamoylphenyl)ethylamino]propanoic acid butyl ester
IUPAC NAME: butyl 3-[1-(4-sulfamoylphenyl)ethylamino]propanoate
SYSTEMATIC NAME: butyl 3-[1-(4-sulfamoylphenyl)ethylamino]propanoate
MOLECULAR FORMULA: C15H24N2O4S
MOLECULAR WEIGHT: 328.42706
SMILES: CCCCOC(=O)CCNC(C)C1=CC=C(C=C1)S(=O)(=O)N
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Product OPENEYE NAME: 3-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(methyl)amino]-N-(5-methylisoxazol-3-yl)propanamide
CAS Name: 3-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(methyl)amino]-N-(5-methyl-3-isoxazolyl)propanamide
IUPAC NAME: 3-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(methyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide
SYSTEMATIC NAME: 3-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(methyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide
MOLECULAR FORMULA: C17H21N3O4
MOLECULAR WEIGHT: 331.36634
SMILES: CC1=CC(=NO1)NC(=O)CCN(C)CC2=CC3=C(C=C2)OCCO3
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Product OPENEYE NAME: 3-[3-(1,3-benzothiazol-2-yl)-1-piperidyl]propanamide
CAS Name: 3-[3-(1,3-benzothiazol-2-yl)-1-piperidinyl]propanamide
IUPAC NAME: 3-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]propanamide
SYSTEMATIC NAME: 3-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]propanamide
MOLECULAR FORMULA: C15H19N3OS
MOLECULAR WEIGHT: 289.39586
SMILES: C1CC(CN(C1)CCC(=O)N)C2=NC3=CC=CC=C3S2
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Product OPENEYE NAME: ethyl 1-[2-(4-pyridyl)ethyl]piperidine-4-carboxylate
CAS Name: 1-(2-pyridin-4-ylethyl)-4-piperidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 1-(2-pyridin-4-ylethyl)piperidine-4-carboxylate
SYSTEMATIC NAME: ethyl 1-(2-pyridin-4-ylethyl)piperidine-4-carboxylate
MOLECULAR FORMULA: C15H22N2O2
MOLECULAR WEIGHT: 262.34738
SMILES: CCOC(=O)C1CCN(CC1)CCC2=CC=NC=C2
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Product OPENEYE NAME: 2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]pentanedinitrile
CAS Name: 2-[[4-(4-fluorophenyl)-1-piperazinyl]methyl]pentanedinitrile
IUPAC NAME: 2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]pentanedinitrile
SYSTEMATIC NAME: 2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]pentanedinitrile
MOLECULAR FORMULA: C16H19FN4
MOLECULAR WEIGHT: 286.347263
SMILES: C1CN(CCN1CC(CCC#N)C#N)C2=CC=C(C=C2)F
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Product OPENEYE NAME: ethyl 1-[2-(4-pyridyl)ethyl]piperidine-3-carboxylate
CAS Name: 1-(2-pyridin-4-ylethyl)-3-piperidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 1-(2-pyridin-4-ylethyl)piperidine-3-carboxylate
SYSTEMATIC NAME: ethyl 1-(2-pyridin-4-ylethyl)piperidine-3-carboxylate
MOLECULAR FORMULA: C15H22N2O2
MOLECULAR WEIGHT: 262.34738
SMILES: CCOC(=O)C1CCCN(C1)CCC2=CC=NC=C2
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