Tuesday, May 28, 2013

All Chemical Compounds Information




Product OPENEYE NAME: ethyl (3R)-4-[3-(1H-indol-3-yl)propanoyl]thiomorpholine-3-carboxylate
CAS Name: (3R)-4-[3-(1H-indol-3-yl)-1-oxopropyl]-3-thiomorpholinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (3R)-4-[3-(1H-indol-3-yl)propanoyl]thiomorpholine-3-carboxylate
SYSTEMATIC NAME: ethyl (3R)-4-[3-(1H-indol-3-yl)propanoyl]thiomorpholine-3-carboxylate
MOLECULAR FORMULA: C18H22N2O3S
MOLECULAR WEIGHT: 346.44388
SMILES: CCOC(=O)[C@@H]1CSCCN1C(=O)CCC2=CNC3=CC=CC=C32
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Product OPENEYE NAME: ethyl (3S)-4-[3-(1H-indol-3-yl)propanoyl]thiomorpholine-3-carboxylate
CAS Name: (3S)-4-[3-(1H-indol-3-yl)-1-oxopropyl]-3-thiomorpholinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (3S)-4-[3-(1H-indol-3-yl)propanoyl]thiomorpholine-3-carboxylate
SYSTEMATIC NAME: ethyl (3S)-4-[3-(1H-indol-3-yl)propanoyl]thiomorpholine-3-carboxylate
MOLECULAR FORMULA: C18H22N2O3S
MOLECULAR WEIGHT: 346.44388
SMILES: CCOC(=O)[C@H]1CSCCN1C(=O)CCC2=CNC3=CC=CC=C32
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Product OPENEYE NAME: ethyl (3R)-4-(4-isopropoxybenzoyl)thiomorpholine-3-carboxylate
CAS Name: (3R)-4-[oxo-(4-propan-2-yloxyphenyl)methyl]-3-thiomorpholinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (3R)-4-(4-propan-2-yloxybenzoyl)thiomorpholine-3-carboxylate
SYSTEMATIC NAME: ethyl (3R)-4-(4-propan-2-yloxyphenyl)carbonylthiomorpholine-3-carboxylate
MOLECULAR FORMULA: C17H23NO4S
MOLECULAR WEIGHT: 337.43382
SMILES: CCOC(=O)[C@@H]1CSCCN1C(=O)C2=CC=C(C=C2)OC(C)C
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Product OPENEYE NAME: ethyl (3S)-4-(4-isopropoxybenzoyl)thiomorpholine-3-carboxylate
CAS Name: (3S)-4-[oxo-(4-propan-2-yloxyphenyl)methyl]-3-thiomorpholinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (3S)-4-(4-propan-2-yloxybenzoyl)thiomorpholine-3-carboxylate
SYSTEMATIC NAME: ethyl (3S)-4-(4-propan-2-yloxyphenyl)carbonylthiomorpholine-3-carboxylate
MOLECULAR FORMULA: C17H23NO4S
MOLECULAR WEIGHT: 337.43382
SMILES: CCOC(=O)[C@H]1CSCCN1C(=O)C2=CC=C(C=C2)OC(C)C
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Product OPENEYE NAME: ethyl (3R)-4-[(E)-3-(2-fluorophenyl)prop-2-enoyl]thiomorpholine-3-carboxylate
CAS Name: (3R)-4-[(E)-3-(2-fluorophenyl)-1-oxoprop-2-enyl]-3-thiomorpholinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (3R)-4-[(E)-3-(2-fluorophenyl)prop-2-enoyl]thiomorpholine-3-carboxylate
SYSTEMATIC NAME: ethyl (3R)-4-[(E)-3-(2-fluorophenyl)prop-2-enoyl]thiomorpholine-3-carboxylate
MOLECULAR FORMULA: C16H18FNO3S
MOLECULAR WEIGHT: 323.382423
SMILES: CCOC(=O)[C@@H]1CSCCN1C(=O)/C=C/C2=CC=CC=C2F
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Product OPENEYE NAME: ethyl (3S)-4-[(E)-3-(2-fluorophenyl)prop-2-enoyl]thiomorpholine-3-carboxylate
CAS Name: (3S)-4-[(E)-3-(2-fluorophenyl)-1-oxoprop-2-enyl]-3-thiomorpholinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (3S)-4-[(E)-3-(2-fluorophenyl)prop-2-enoyl]thiomorpholine-3-carboxylate
SYSTEMATIC NAME: ethyl (3S)-4-[(E)-3-(2-fluorophenyl)prop-2-enoyl]thiomorpholine-3-carboxylate
MOLECULAR FORMULA: C16H18FNO3S
MOLECULAR WEIGHT: 323.382423
SMILES: CCOC(=O)[C@H]1CSCCN1C(=O)/C=C/C2=CC=CC=C2F
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Product OPENEYE NAME: ethyl (3R)-4-[5-[3-(trifluoromethyl)phenyl]furan-2-carbonyl]thiomorpholine-3-carboxylate
CAS Name: (3R)-4-[oxo-[5-[3-(trifluoromethyl)phenyl]-2-furanyl]methyl]-3-thiomorpholinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (3R)-4-[5-[3-(trifluoromethyl)phenyl]furan-2-carbonyl]thiomorpholine-3-carboxylate
SYSTEMATIC NAME: ethyl (3R)-4-[5-[3-(trifluoromethyl)phenyl]furan-2-yl]carbonylthiomorpholine-3-carboxylate
MOLECULAR FORMULA: C19H18F3NO4S
MOLECULAR WEIGHT: 413.41073
SMILES: CCOC(=O)[C@@H]1CSCCN1C(=O)C2=CC=C(O2)C3=CC(=CC=C3)C(F)(F)F
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Product OPENEYE NAME: ethyl (3S)-4-[5-[3-(trifluoromethyl)phenyl]furan-2-carbonyl]thiomorpholine-3-carboxylate
CAS Name: (3S)-4-[oxo-[5-[3-(trifluoromethyl)phenyl]-2-furanyl]methyl]-3-thiomorpholinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (3S)-4-[5-[3-(trifluoromethyl)phenyl]furan-2-carbonyl]thiomorpholine-3-carboxylate
SYSTEMATIC NAME: ethyl (3S)-4-[5-[3-(trifluoromethyl)phenyl]furan-2-yl]carbonylthiomorpholine-3-carboxylate
MOLECULAR FORMULA: C19H18F3NO4S
MOLECULAR WEIGHT: 413.41073
SMILES: CCOC(=O)[C@H]1CSCCN1C(=O)C2=CC=C(O2)C3=CC(=CC=C3)C(F)(F)F
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Product OPENEYE NAME: ethyl (3R)-4-(4,5-dihydrobenzo[g]benzothiophene-2-carbonyl)thiomorpholine-3-carboxylate
CAS Name: (3R)-4-[4,5-dihydrobenzo[g][1]benzothiol-2-yl(oxo)methyl]-3-thiomorpholinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (3R)-4-(4,5-dihydrobenzo[g][1]benzothiole-2-carbonyl)thiomorpholine-3-carboxylate
SYSTEMATIC NAME: ethyl (3R)-4-(4,5-dihydrobenzo[g][1]benzothiol-2-ylcarbonyl)thiomorpholine-3-carboxylate
MOLECULAR FORMULA: C20H21NO3S2
MOLECULAR WEIGHT: 387.51564
SMILES: CCOC(=O)[C@@H]1CSCCN1C(=O)C2=CC3=C(S2)C4=CC=CC=C4CC3
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Product OPENEYE NAME: ethyl (3S)-4-(4,5-dihydrobenzo[g]benzothiophene-2-carbonyl)thiomorpholine-3-carboxylate
CAS Name: (3S)-4-[4,5-dihydrobenzo[g][1]benzothiol-2-yl(oxo)methyl]-3-thiomorpholinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (3S)-4-(4,5-dihydrobenzo[g][1]benzothiole-2-carbonyl)thiomorpholine-3-carboxylate
SYSTEMATIC NAME: ethyl (3S)-4-(4,5-dihydrobenzo[g][1]benzothiol-2-ylcarbonyl)thiomorpholine-3-carboxylate
MOLECULAR FORMULA: C20H21NO3S2
MOLECULAR WEIGHT: 387.51564
SMILES: CCOC(=O)[C@H]1CSCCN1C(=O)C2=CC3=C(S2)C4=CC=CC=C4CC3
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Product OPENEYE NAME: ethyl (3R)-4-[1-(4-chlorophenyl)-6-methyl-4-oxo-pyridazine-3-carbonyl]thiomorpholine-3-carboxylate
CAS Name: (3R)-4-[[1-(4-chlorophenyl)-6-methyl-4-oxo-3-pyridazinyl]-oxomethyl]-3-thiomorpholinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (3R)-4-[1-(4-chlorophenyl)-6-methyl-4-oxopyridazine-3-carbonyl]thiomorpholine-3-carboxylate
SYSTEMATIC NAME: ethyl (3R)-4-[1-(4-chlorophenyl)-6-methyl-4-oxidanylidene-pyridazin-3-yl]carbonylthiomorpholine-3-carboxylate
MOLECULAR FORMULA: C19H20ClN3O4S
MOLECULAR WEIGHT: 421.8978
SMILES: CCOC(=O)[C@@H]1CSCCN1C(=O)C2=NN(C(=CC2=O)C)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: ethyl (3S)-4-[1-(4-chlorophenyl)-6-methyl-4-oxo-pyridazine-3-carbonyl]thiomorpholine-3-carboxylate
CAS Name: (3S)-4-[[1-(4-chlorophenyl)-6-methyl-4-oxo-3-pyridazinyl]-oxomethyl]-3-thiomorpholinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (3S)-4-[1-(4-chlorophenyl)-6-methyl-4-oxopyridazine-3-carbonyl]thiomorpholine-3-carboxylate
SYSTEMATIC NAME: ethyl (3S)-4-[1-(4-chlorophenyl)-6-methyl-4-oxidanylidene-pyridazin-3-yl]carbonylthiomorpholine-3-carboxylate
MOLECULAR FORMULA: C19H20ClN3O4S
MOLECULAR WEIGHT: 421.8978
SMILES: CCOC(=O)[C@H]1CSCCN1C(=O)C2=NN(C(=CC2=O)C)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: ethyl (3R)-4-[2-[2-(2-chlorophenyl)thiazol-4-yl]acetyl]thiomorpholine-3-carboxylate
CAS Name: (3R)-4-[2-[2-(2-chlorophenyl)-4-thiazolyl]-1-oxoethyl]-3-thiomorpholinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (3R)-4-[2-[2-(2-chlorophenyl)-1,3-thiazol-4-yl]acetyl]thiomorpholine-3-carboxylate
SYSTEMATIC NAME: ethyl (3R)-4-[2-[2-(2-chlorophenyl)-1,3-thiazol-4-yl]ethanoyl]thiomorpholine-3-carboxylate
MOLECULAR FORMULA: C18H19ClN2O3S2
MOLECULAR WEIGHT: 410.93806
SMILES: CCOC(=O)[C@@H]1CSCCN1C(=O)CC2=CSC(=N2)C3=CC=CC=C3Cl
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Product OPENEYE NAME: ethyl (3S)-4-[2-[2-(2-chlorophenyl)thiazol-4-yl]acetyl]thiomorpholine-3-carboxylate
CAS Name: (3S)-4-[2-[2-(2-chlorophenyl)-4-thiazolyl]-1-oxoethyl]-3-thiomorpholinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (3S)-4-[2-[2-(2-chlorophenyl)-1,3-thiazol-4-yl]acetyl]thiomorpholine-3-carboxylate
SYSTEMATIC NAME: ethyl (3S)-4-[2-[2-(2-chlorophenyl)-1,3-thiazol-4-yl]ethanoyl]thiomorpholine-3-carboxylate
MOLECULAR FORMULA: C18H19ClN2O3S2
MOLECULAR WEIGHT: 410.93806
SMILES: CCOC(=O)[C@H]1CSCCN1C(=O)CC2=CSC(=N2)C3=CC=CC=C3Cl
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Product OPENEYE NAME: ethyl (3R)-4-[6-methyl-4-oxo-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carbonyl]thiomorpholine-3-carboxylate
CAS Name: (3R)-4-[[6-methyl-4-oxo-1-[2-(trifluoromethyl)phenyl]-3-pyridazinyl]-oxomethyl]-3-thiomorpholinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (3R)-4-[6-methyl-4-oxo-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carbonyl]thiomorpholine-3-carboxylate
SYSTEMATIC NAME: ethyl (3R)-4-[6-methyl-4-oxidanylidene-1-[2-(trifluoromethyl)phenyl]pyridazin-3-yl]carbonylthiomorpholine-3-carboxylate
MOLECULAR FORMULA: C20H20F3N3O4S
MOLECULAR WEIGHT: 455.45071
SMILES: CCOC(=O)[C@@H]1CSCCN1C(=O)C2=NN(C(=CC2=O)C)C3=CC=CC=C3C(F)(F)F
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Product OPENEYE NAME: ethyl (3S)-4-[6-methyl-4-oxo-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carbonyl]thiomorpholine-3-carboxylate
CAS Name: (3S)-4-[[6-methyl-4-oxo-1-[2-(trifluoromethyl)phenyl]-3-pyridazinyl]-oxomethyl]-3-thiomorpholinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (3S)-4-[6-methyl-4-oxo-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carbonyl]thiomorpholine-3-carboxylate
SYSTEMATIC NAME: ethyl (3S)-4-[6-methyl-4-oxidanylidene-1-[2-(trifluoromethyl)phenyl]pyridazin-3-yl]carbonylthiomorpholine-3-carboxylate
MOLECULAR FORMULA: C20H20F3N3O4S
MOLECULAR WEIGHT: 455.45071
SMILES: CCOC(=O)[C@H]1CSCCN1C(=O)C2=NN(C(=CC2=O)C)C3=CC=CC=C3C(F)(F)F
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Product OPENEYE NAME: ethyl (3R)-4-[2-(3,4-dimethoxyphenyl)thiazole-4-carbonyl]thiomorpholine-3-carboxylate
CAS Name: (3R)-4-[[2-(3,4-dimethoxyphenyl)-4-thiazolyl]-oxomethyl]-3-thiomorpholinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (3R)-4-[2-(3,4-dimethoxyphenyl)-1,3-thiazole-4-carbonyl]thiomorpholine-3-carboxylate
SYSTEMATIC NAME: ethyl (3R)-4-[[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]carbonyl]thiomorpholine-3-carboxylate
MOLECULAR FORMULA: C19H22N2O5S2
MOLECULAR WEIGHT: 422.51838
SMILES: CCOC(=O)[C@@H]1CSCCN1C(=O)C2=CSC(=N2)C3=CC(=C(C=C3)OC)OC
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Product OPENEYE NAME: ethyl (3S)-4-[2-(3,4-dimethoxyphenyl)thiazole-4-carbonyl]thiomorpholine-3-carboxylate
CAS Name: (3S)-4-[[2-(3,4-dimethoxyphenyl)-4-thiazolyl]-oxomethyl]-3-thiomorpholinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (3S)-4-[2-(3,4-dimethoxyphenyl)-1,3-thiazole-4-carbonyl]thiomorpholine-3-carboxylate
SYSTEMATIC NAME: ethyl (3S)-4-[[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]carbonyl]thiomorpholine-3-carboxylate
MOLECULAR FORMULA: C19H22N2O5S2
MOLECULAR WEIGHT: 422.51838
SMILES: CCOC(=O)[C@H]1CSCCN1C(=O)C2=CSC(=N2)C3=CC(=C(C=C3)OC)OC
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Product OPENEYE NAME: ethyl (3R)-4-[3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)propanoyl]thiomorpholine-3-carboxylate
CAS Name: (3R)-4-[3-(2,4-dimethyl-3-pyrimido[1,2-b]indazolyl)-1-oxopropyl]-3-thiomorpholinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (3R)-4-[3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)propanoyl]thiomorpholine-3-carboxylate
SYSTEMATIC NAME: ethyl (3R)-4-[3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)propanoyl]thiomorpholine-3-carboxylate
MOLECULAR FORMULA: C22H26N4O3S
MOLECULAR WEIGHT: 426.53184
SMILES: CCOC(=O)[C@@H]1CSCCN1C(=O)CCC2=C(N3C(=C4C=CC=CC4=N3)N=C2C)C
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