Thursday, February 28, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-N-[(1S)-1-(2-thienyl)ethyl]acetamide
CAS Name: 2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-N-[(1S)-1-thiophen-2-ylethyl]acetamide
IUPAC NAME: 2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanyl-N-[(1S)-1-thiophen-2-ylethyl]acetamide
SYSTEMATIC NAME: 2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-N-[(1S)-1-thiophen-2-ylethyl]ethanamide
MOLECULAR FORMULA: C19H19N3OS2
MOLECULAR WEIGHT: 369.50366
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)N[C@@H](C)C3=CC=CS3
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Product OPENEYE NAME: [(1R)-2-(isopropylcarbamoylamino)-1-methyl-2-oxo-ethyl] 3-(4-methoxyphenyl)propanoate
CAS Name: 3-(4-methoxyphenyl)propanoic acid [(2R)-1-oxo-1-[[oxo-(propan-2-ylamino)methyl]amino]propan-2-yl] ester
IUPAC NAME: [(2R)-1-oxo-1-(propan-2-ylcarbamoylamino)propan-2-yl] 3-(4-methoxyphenyl)propanoate
SYSTEMATIC NAME: [(2R)-1-oxidanylidene-1-(propan-2-ylcarbamoylamino)propan-2-yl] 3-(4-methoxyphenyl)propanoate
MOLECULAR FORMULA: C17H24N2O5
MOLECULAR WEIGHT: 336.38286
SMILES: C[C@H](C(=O)NC(=O)NC(C)C)OC(=O)CCC1=CC=C(C=C1)OC
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Product OPENEYE NAME: [2-[[(3S)-1,1-dioxothiolan-3-yl]amino]-2-oxo-ethyl] 3-(2-ethoxyphenyl)propanoate
CAS Name: 3-(2-ethoxyphenyl)propanoic acid [2-[[(3S)-1,1-dioxo-3-thiolanyl]amino]-2-oxoethyl] ester
IUPAC NAME: [2-[[(3S)-1,1-dioxothiolan-3-yl]amino]-2-oxoethyl] 3-(2-ethoxyphenyl)propanoate
SYSTEMATIC NAME: [2-[[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]amino]-2-oxidanylidene-ethyl] 3-(2-ethoxyphenyl)propanoate
MOLECULAR FORMULA: C17H23NO6S
MOLECULAR WEIGHT: 369.43262
SMILES: CCOC1=CC=CC=C1CCC(=O)OCC(=O)N[C@H]2CCS(=O)(=O)C2
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Product OPENEYE NAME: [(1S)-2-(isopropylcarbamoylamino)-1-methyl-2-oxo-ethyl] 3-(4-methoxyphenyl)propanoate
CAS Name: 3-(4-methoxyphenyl)propanoic acid [(2S)-1-oxo-1-[[oxo-(propan-2-ylamino)methyl]amino]propan-2-yl] ester
IUPAC NAME: [(2S)-1-oxo-1-(propan-2-ylcarbamoylamino)propan-2-yl] 3-(4-methoxyphenyl)propanoate
SYSTEMATIC NAME: [(2S)-1-oxidanylidene-1-(propan-2-ylcarbamoylamino)propan-2-yl] 3-(4-methoxyphenyl)propanoate
MOLECULAR FORMULA: C17H24N2O5
MOLECULAR WEIGHT: 336.38286
SMILES: C[C@@H](C(=O)NC(=O)NC(C)C)OC(=O)CCC1=CC=C(C=C1)OC
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Product OPENEYE NAME: [2-(4-acetamidophenyl)-2-oxo-ethyl] 3-(2-ethoxyphenyl)propanoate
CAS Name: 3-(2-ethoxyphenyl)propanoic acid [2-(4-acetamidophenyl)-2-oxoethyl] ester
IUPAC NAME: [2-(4-acetamidophenyl)-2-oxoethyl] 3-(2-ethoxyphenyl)propanoate
SYSTEMATIC NAME: [2-(4-acetamidophenyl)-2-oxidanylidene-ethyl] 3-(2-ethoxyphenyl)propanoate
MOLECULAR FORMULA: C21H23NO5
MOLECULAR WEIGHT: 369.41102
SMILES: CCOC1=CC=CC=C1CCC(=O)OCC(=O)C2=CC=C(C=C2)NC(=O)C
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Product OPENEYE NAME: [2-[(3-carbamoyl-2-thienyl)amino]-2-oxo-ethyl] 3-(2-ethoxyphenyl)propanoate
CAS Name: 3-(2-ethoxyphenyl)propanoic acid [2-[(3-carbamoyl-2-thiophenyl)amino]-2-oxoethyl] ester
IUPAC NAME: [2-[(3-carbamoylthiophen-2-yl)amino]-2-oxoethyl] 3-(2-ethoxyphenyl)propanoate
SYSTEMATIC NAME: [2-[(3-aminocarbonylthiophen-2-yl)amino]-2-oxidanylidene-ethyl] 3-(2-ethoxyphenyl)propanoate
MOLECULAR FORMULA: C18H20N2O5S
MOLECULAR WEIGHT: 376.4268
SMILES: CCOC1=CC=CC=C1CCC(=O)OCC(=O)NC2=C(C=CS2)C(=O)N
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Product OPENEYE NAME: [(1S)-2-(cyclopentylcarbamoylamino)-1-methyl-2-oxo-ethyl] 3-(4-methoxyphenyl)propanoate
CAS Name: 3-(4-methoxyphenyl)propanoic acid [(2S)-1-[[(cyclopentylamino)-oxomethyl]amino]-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-(cyclopentylcarbamoylamino)-1-oxopropan-2-yl] 3-(4-methoxyphenyl)propanoate
SYSTEMATIC NAME: [(2S)-1-(cyclopentylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 3-(4-methoxyphenyl)propanoate
MOLECULAR FORMULA: C19H26N2O5
MOLECULAR WEIGHT: 362.42014
SMILES: C[C@@H](C(=O)NC(=O)NC1CCCC1)OC(=O)CCC2=CC=C(C=C2)OC
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Product OPENEYE NAME: N-[(1R)-1-(2,4-difluorophenyl)ethyl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-acetamide
CAS Name: N-[(1R)-1-(2,4-difluorophenyl)ethyl]-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]acetamide
IUPAC NAME: N-[(1R)-1-(2,4-difluorophenyl)ethyl]-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylacetamide
SYSTEMATIC NAME: N-[(1R)-1-[2,4-bis(fluoranyl)phenyl]ethyl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanamide
MOLECULAR FORMULA: C21H19F2N3OS
MOLECULAR WEIGHT: 399.456866
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)N[C@H](C)C3=C(C=C(C=C3)F)F
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Product OPENEYE NAME: [2-[(3-cyano-2-thienyl)amino]-2-oxo-ethyl] 3-(2-ethoxyphenyl)propanoate
CAS Name: 3-(2-ethoxyphenyl)propanoic acid [2-[(3-cyano-2-thiophenyl)amino]-2-oxoethyl] ester
IUPAC NAME: [2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl] 3-(2-ethoxyphenyl)propanoate
SYSTEMATIC NAME: [2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl] 3-(2-ethoxyphenyl)propanoate
MOLECULAR FORMULA: C18H18N2O4S
MOLECULAR WEIGHT: 358.41152
SMILES: CCOC1=CC=CC=C1CCC(=O)OCC(=O)NC2=C(C=CS2)C#N
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Product OPENEYE NAME: N-[(3R)-3-methyl-1,1-dioxo-thiolan-3-yl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-acetamide
CAS Name: N-[(3R)-3-methyl-1,1-dioxo-3-thiolanyl]-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]acetamide
IUPAC NAME: N-[(3R)-3-methyl-1,1-dioxothiolan-3-yl]-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylacetamide
SYSTEMATIC NAME: N-[(3R)-3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanamide
MOLECULAR FORMULA: C18H21N3O3S2
MOLECULAR WEIGHT: 391.50764
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)N[C@@]3(CCS(=O)(=O)C3)C
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Product OPENEYE NAME: [(1R)-2-(cyclopentylcarbamoylamino)-1-methyl-2-oxo-ethyl] 3-(4-methoxyphenyl)propanoate
CAS Name: 3-(4-methoxyphenyl)propanoic acid [(2R)-1-[[(cyclopentylamino)-oxomethyl]amino]-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-(cyclopentylcarbamoylamino)-1-oxopropan-2-yl] 3-(4-methoxyphenyl)propanoate
SYSTEMATIC NAME: [(2R)-1-(cyclopentylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 3-(4-methoxyphenyl)propanoate
MOLECULAR FORMULA: C19H26N2O5
MOLECULAR WEIGHT: 362.42014
SMILES: C[C@H](C(=O)NC(=O)NC1CCCC1)OC(=O)CCC2=CC=C(C=C2)OC
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