Monday, May 27, 2013

All Chemical Compounds Information




Product OPENEYE NAME: [(1S)-1-(3-methoxyphenyl)-2-[[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]amino]ethyl]-dimethyl-ammonium
CAS Name: [(1S)-1-(3-methoxyphenyl)-2-[[(E)-1-oxo-3-(1-phenyl-4-pyrazolyl)prop-2-enyl]amino]ethyl]-dimethylammonium
IUPAC NAME: [(1S)-1-(3-methoxyphenyl)-2-[[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]amino]ethyl]-dimethylazanium
SYSTEMATIC NAME: [(1S)-1-(3-methoxyphenyl)-2-[[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]amino]ethyl]-dimethyl-azanium
MOLECULAR FORMULA: C23H27N4O2+
MOLECULAR WEIGHT: 391.48608
SMILES: C[NH+](C)[C@H](CNC(=O)/C=C/C1=CN(N=C1)C2=CC=CC=C2)C3=CC(=CC=C3)OC
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Product OPENEYE NAME: (E)-N-[(2S)-2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]-3-(1-phenylpyrazol-4-yl)prop-2-enamide
CAS Name: (E)-N-[(2S)-2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]-3-(1-phenyl-4-pyrazolyl)-2-propenamide
IUPAC NAME: (E)-N-[(2S)-2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]-3-(1-phenylpyrazol-4-yl)prop-2-enamide
SYSTEMATIC NAME: (E)-N-[(2S)-2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]-3-(1-phenylpyrazol-4-yl)prop-2-enamide
MOLECULAR FORMULA: C23H26N4O2
MOLECULAR WEIGHT: 390.47814
SMILES: CN(C)[C@H](CNC(=O)/C=C/C1=CN(N=C1)C2=CC=CC=C2)C3=CC(=CC=C3)OC
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Product OPENEYE NAME: [(1R)-1-(3-methoxyphenyl)-2-[[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]amino]ethyl]-dimethyl-ammonium
CAS Name: [(1R)-1-(3-methoxyphenyl)-2-[[(E)-1-oxo-3-(1-phenyl-4-pyrazolyl)prop-2-enyl]amino]ethyl]-dimethylammonium
IUPAC NAME: [(1R)-1-(3-methoxyphenyl)-2-[[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]amino]ethyl]-dimethylazanium
SYSTEMATIC NAME: [(1R)-1-(3-methoxyphenyl)-2-[[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]amino]ethyl]-dimethyl-azanium
MOLECULAR FORMULA: C23H27N4O2+
MOLECULAR WEIGHT: 391.48608
SMILES: C[NH+](C)[C@@H](CNC(=O)/C=C/C1=CN(N=C1)C2=CC=CC=C2)C3=CC(=CC=C3)OC
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Product OPENEYE NAME: (E)-N-[(2R)-2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]-3-(1-phenylpyrazol-4-yl)prop-2-enamide
CAS Name: (E)-N-[(2R)-2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]-3-(1-phenyl-4-pyrazolyl)-2-propenamide
IUPAC NAME: (E)-N-[(2R)-2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]-3-(1-phenylpyrazol-4-yl)prop-2-enamide
SYSTEMATIC NAME: (E)-N-[(2R)-2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]-3-(1-phenylpyrazol-4-yl)prop-2-enamide
MOLECULAR FORMULA: C23H26N4O2
MOLECULAR WEIGHT: 390.47814
SMILES: CN(C)[C@@H](CNC(=O)/C=C/C1=CN(N=C1)C2=CC=CC=C2)C3=CC(=CC=C3)OC
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Product OPENEYE NAME: N-[3-(azepan-1-ium-1-yl)propyl]-4,6-dimethyl-thieno[2,3-b]pyridine-2-carboxamide
CAS Name: N-[3-(1-azepan-1-iumyl)propyl]-4,6-dimethyl-2-thieno[2,3-b]pyridinecarboxamide
IUPAC NAME: N-[3-(azepan-1-ium-1-yl)propyl]-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide
SYSTEMATIC NAME: N-[3-(azepan-1-ium-1-yl)propyl]-4,6-dimethyl-thieno[2,3-b]pyridine-2-carboxamide
MOLECULAR FORMULA: C19H28N3OS+
MOLECULAR WEIGHT: 346.51012
SMILES: CC1=CC(=NC2=C1C=C(S2)C(=O)NCCC[NH+]3CCCCCC3)C
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Product OPENEYE NAME: N-[3-(azepan-1-yl)propyl]-4,6-dimethyl-thieno[2,3-b]pyridine-2-carboxamide
CAS Name: N-[3-(1-azepanyl)propyl]-4,6-dimethyl-2-thieno[2,3-b]pyridinecarboxamide
IUPAC NAME: N-[3-(azepan-1-yl)propyl]-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide
SYSTEMATIC NAME: N-[3-(azepan-1-yl)propyl]-4,6-dimethyl-thieno[2,3-b]pyridine-2-carboxamide
MOLECULAR FORMULA: C19H27N3OS
MOLECULAR WEIGHT: 345.50218
SMILES: CC1=CC(=NC2=C1C=C(S2)C(=O)NCCCN3CCCCCC3)C
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Product OPENEYE NAME: [(1R)-2-[(2-chloro-6-fluoro-benzoyl)amino]-1-phenyl-ethyl]-diethyl-ammonium
CAS Name: [(1R)-2-[[(2-chloro-6-fluorophenyl)-oxomethyl]amino]-1-phenylethyl]-diethylammonium
IUPAC NAME: [(1R)-2-[(2-chloro-6-fluorobenzoyl)amino]-1-phenylethyl]-diethylazanium
SYSTEMATIC NAME: [(1R)-2-[(2-chloranyl-6-fluoranyl-phenyl)carbonylamino]-1-phenyl-ethyl]-diethyl-azanium
MOLECULAR FORMULA: C19H23ClFN2O+
MOLECULAR WEIGHT: 349.850123
SMILES: CC[NH+](CC)[C@@H](CNC(=O)C1=C(C=CC=C1Cl)F)C2=CC=CC=C2
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Product OPENEYE NAME: 2-chloro-N-[(2R)-2-(diethylamino)-2-phenyl-ethyl]-6-fluoro-benzamide
CAS Name: 2-chloro-N-[(2R)-2-(diethylamino)-2-phenylethyl]-6-fluorobenzamide
IUPAC NAME: 2-chloro-N-[(2R)-2-(diethylamino)-2-phenylethyl]-6-fluorobenzamide
SYSTEMATIC NAME: 2-chloranyl-N-[(2R)-2-(diethylamino)-2-phenyl-ethyl]-6-fluoranyl-benzamide
MOLECULAR FORMULA: C19H22ClFN2O
MOLECULAR WEIGHT: 348.842183
SMILES: CCN(CC)[C@@H](CNC(=O)C1=C(C=CC=C1Cl)F)C2=CC=CC=C2
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Product OPENEYE NAME: [(1S)-2-[(2-chloro-6-fluoro-benzoyl)amino]-1-phenyl-ethyl]-diethyl-ammonium
CAS Name: [(1S)-2-[[(2-chloro-6-fluorophenyl)-oxomethyl]amino]-1-phenylethyl]-diethylammonium
IUPAC NAME: [(1S)-2-[(2-chloro-6-fluorobenzoyl)amino]-1-phenylethyl]-diethylazanium
SYSTEMATIC NAME: [(1S)-2-[(2-chloranyl-6-fluoranyl-phenyl)carbonylamino]-1-phenyl-ethyl]-diethyl-azanium
MOLECULAR FORMULA: C19H23ClFN2O+
MOLECULAR WEIGHT: 349.850123
SMILES: CC[NH+](CC)[C@H](CNC(=O)C1=C(C=CC=C1Cl)F)C2=CC=CC=C2
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Product OPENEYE NAME: 2-chloro-N-[(2S)-2-(diethylamino)-2-phenyl-ethyl]-6-fluoro-benzamide
CAS Name: 2-chloro-N-[(2S)-2-(diethylamino)-2-phenylethyl]-6-fluorobenzamide
IUPAC NAME: 2-chloro-N-[(2S)-2-(diethylamino)-2-phenylethyl]-6-fluorobenzamide
SYSTEMATIC NAME: 2-chloranyl-N-[(2S)-2-(diethylamino)-2-phenyl-ethyl]-6-fluoranyl-benzamide
MOLECULAR FORMULA: C19H22ClFN2O
MOLECULAR WEIGHT: 348.842183
SMILES: CCN(CC)[C@H](CNC(=O)C1=C(C=CC=C1Cl)F)C2=CC=CC=C2
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Product OPENEYE NAME: diethyl-[(1R)-2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]-1-phenyl-ethyl]ammonium
CAS Name: diethyl-[(1R)-2-[[(E)-3-(4-methoxyphenyl)-1-oxoprop-2-enyl]amino]-1-phenylethyl]ammonium
IUPAC NAME: diethyl-[(1R)-2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]-1-phenylethyl]azanium
SYSTEMATIC NAME: diethyl-[(1R)-2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]-1-phenyl-ethyl]azanium
MOLECULAR FORMULA: C22H29N2O2+
MOLECULAR WEIGHT: 353.47786
SMILES: CC[NH+](CC)[C@@H](CNC(=O)/C=C/C1=CC=C(C=C1)OC)C2=CC=CC=C2
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Product OPENEYE NAME: (E)-N-[(2R)-2-(diethylamino)-2-phenyl-ethyl]-3-(4-methoxyphenyl)prop-2-enamide
CAS Name: (E)-N-[(2R)-2-(diethylamino)-2-phenylethyl]-3-(4-methoxyphenyl)-2-propenamide
IUPAC NAME: (E)-N-[(2R)-2-(diethylamino)-2-phenylethyl]-3-(4-methoxyphenyl)prop-2-enamide
SYSTEMATIC NAME: (E)-N-[(2R)-2-(diethylamino)-2-phenyl-ethyl]-3-(4-methoxyphenyl)prop-2-enamide
MOLECULAR FORMULA: C22H28N2O2
MOLECULAR WEIGHT: 352.46992
SMILES: CCN(CC)[C@@H](CNC(=O)/C=C/C1=CC=C(C=C1)OC)C2=CC=CC=C2
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Product OPENEYE NAME: diethyl-[(1S)-2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]-1-phenyl-ethyl]ammonium
CAS Name: diethyl-[(1S)-2-[[(E)-3-(4-methoxyphenyl)-1-oxoprop-2-enyl]amino]-1-phenylethyl]ammonium
IUPAC NAME: diethyl-[(1S)-2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]-1-phenylethyl]azanium
SYSTEMATIC NAME: diethyl-[(1S)-2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]-1-phenyl-ethyl]azanium
MOLECULAR FORMULA: C22H29N2O2+
MOLECULAR WEIGHT: 353.47786
SMILES: CC[NH+](CC)[C@H](CNC(=O)/C=C/C1=CC=C(C=C1)OC)C2=CC=CC=C2
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Product OPENEYE NAME: (E)-N-[(2S)-2-(diethylamino)-2-phenyl-ethyl]-3-(4-methoxyphenyl)prop-2-enamide
CAS Name: (E)-N-[(2S)-2-(diethylamino)-2-phenylethyl]-3-(4-methoxyphenyl)-2-propenamide
IUPAC NAME: (E)-N-[(2S)-2-(diethylamino)-2-phenylethyl]-3-(4-methoxyphenyl)prop-2-enamide
SYSTEMATIC NAME: (E)-N-[(2S)-2-(diethylamino)-2-phenyl-ethyl]-3-(4-methoxyphenyl)prop-2-enamide
MOLECULAR FORMULA: C22H28N2O2
MOLECULAR WEIGHT: 352.46992
SMILES: CCN(CC)[C@H](CNC(=O)/C=C/C1=CC=C(C=C1)OC)C2=CC=CC=C2
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Product OPENEYE NAME: diethyl-[(1R)-2-[[(E)-3-(2-nitrophenyl)prop-2-enoyl]amino]-1-phenyl-ethyl]ammonium
CAS Name: diethyl-[(1R)-2-[[(E)-3-(2-nitrophenyl)-1-oxoprop-2-enyl]amino]-1-phenylethyl]ammonium
IUPAC NAME: diethyl-[(1R)-2-[[(E)-3-(2-nitrophenyl)prop-2-enoyl]amino]-1-phenylethyl]azanium
SYSTEMATIC NAME: diethyl-[(1R)-2-[[(E)-3-(2-nitrophenyl)prop-2-enoyl]amino]-1-phenyl-ethyl]azanium
MOLECULAR FORMULA: C21H26N3O3+
MOLECULAR WEIGHT: 368.44944
SMILES: CC[NH+](CC)[C@@H](CNC(=O)/C=C/C1=CC=CC=C1[N+](=O)[O-])C2=CC=CC=C2
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Product OPENEYE NAME: (E)-N-[(2R)-2-(diethylamino)-2-phenyl-ethyl]-3-(2-nitrophenyl)prop-2-enamide
CAS Name: (E)-N-[(2R)-2-(diethylamino)-2-phenylethyl]-3-(2-nitrophenyl)-2-propenamide
IUPAC NAME: (E)-N-[(2R)-2-(diethylamino)-2-phenylethyl]-3-(2-nitrophenyl)prop-2-enamide
SYSTEMATIC NAME: (E)-N-[(2R)-2-(diethylamino)-2-phenyl-ethyl]-3-(2-nitrophenyl)prop-2-enamide
MOLECULAR FORMULA: C21H25N3O3
MOLECULAR WEIGHT: 367.4415
SMILES: CCN(CC)[C@@H](CNC(=O)/C=C/C1=CC=CC=C1[N+](=O)[O-])C2=CC=CC=C2
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Product OPENEYE NAME: diethyl-[(1S)-2-[[(E)-3-(2-nitrophenyl)prop-2-enoyl]amino]-1-phenyl-ethyl]ammonium
CAS Name: diethyl-[(1S)-2-[[(E)-3-(2-nitrophenyl)-1-oxoprop-2-enyl]amino]-1-phenylethyl]ammonium
IUPAC NAME: diethyl-[(1S)-2-[[(E)-3-(2-nitrophenyl)prop-2-enoyl]amino]-1-phenylethyl]azanium
SYSTEMATIC NAME: diethyl-[(1S)-2-[[(E)-3-(2-nitrophenyl)prop-2-enoyl]amino]-1-phenyl-ethyl]azanium
MOLECULAR FORMULA: C21H26N3O3+
MOLECULAR WEIGHT: 368.44944
SMILES: CC[NH+](CC)[C@H](CNC(=O)/C=C/C1=CC=CC=C1[N+](=O)[O-])C2=CC=CC=C2
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Product OPENEYE NAME: (E)-N-[(2S)-2-(diethylamino)-2-phenyl-ethyl]-3-(2-nitrophenyl)prop-2-enamide
CAS Name: (E)-N-[(2S)-2-(diethylamino)-2-phenylethyl]-3-(2-nitrophenyl)-2-propenamide
IUPAC NAME: (E)-N-[(2S)-2-(diethylamino)-2-phenylethyl]-3-(2-nitrophenyl)prop-2-enamide
SYSTEMATIC NAME: (E)-N-[(2S)-2-(diethylamino)-2-phenyl-ethyl]-3-(2-nitrophenyl)prop-2-enamide
MOLECULAR FORMULA: C21H25N3O3
MOLECULAR WEIGHT: 367.4415
SMILES: CCN(CC)[C@H](CNC(=O)/C=C/C1=CC=CC=C1[N+](=O)[O-])C2=CC=CC=C2
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Product OPENEYE NAME: diethyl-[(1R)-2-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]-1-phenyl-ethyl]ammonium
CAS Name: diethyl-[(1R)-2-[[(E)-3-(3-nitrophenyl)-1-oxoprop-2-enyl]amino]-1-phenylethyl]ammonium
IUPAC NAME: diethyl-[(1R)-2-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]-1-phenylethyl]azanium
SYSTEMATIC NAME: diethyl-[(1R)-2-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]-1-phenyl-ethyl]azanium
MOLECULAR FORMULA: C21H26N3O3+
MOLECULAR WEIGHT: 368.44944
SMILES: CC[NH+](CC)[C@@H](CNC(=O)/C=C/C1=CC(=CC=C1)[N+](=O)[O-])C2=CC=CC=C2
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Product OPENEYE NAME: (E)-N-[(2R)-2-(diethylamino)-2-phenyl-ethyl]-3-(3-nitrophenyl)prop-2-enamide
CAS Name: (E)-N-[(2R)-2-(diethylamino)-2-phenylethyl]-3-(3-nitrophenyl)-2-propenamide
IUPAC NAME: (E)-N-[(2R)-2-(diethylamino)-2-phenylethyl]-3-(3-nitrophenyl)prop-2-enamide
SYSTEMATIC NAME: (E)-N-[(2R)-2-(diethylamino)-2-phenyl-ethyl]-3-(3-nitrophenyl)prop-2-enamide
MOLECULAR FORMULA: C21H25N3O3
MOLECULAR WEIGHT: 367.4415
SMILES: CCN(CC)[C@@H](CNC(=O)/C=C/C1=CC(=CC=C1)[N+](=O)[O-])C2=CC=CC=C2
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Product OPENEYE NAME: diethyl-[(1S)-2-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]-1-phenyl-ethyl]ammonium
CAS Name: diethyl-[(1S)-2-[[(E)-3-(3-nitrophenyl)-1-oxoprop-2-enyl]amino]-1-phenylethyl]ammonium
IUPAC NAME: diethyl-[(1S)-2-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]-1-phenylethyl]azanium
SYSTEMATIC NAME: diethyl-[(1S)-2-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]-1-phenyl-ethyl]azanium
MOLECULAR FORMULA: C21H26N3O3+
MOLECULAR WEIGHT: 368.44944
SMILES: CC[NH+](CC)[C@H](CNC(=O)/C=C/C1=CC(=CC=C1)[N+](=O)[O-])C2=CC=CC=C2
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