Tuesday, May 7, 2013

All Chemical Compounds Information




Product OPENEYE NAME: N-[3-[(1S)-1-[methyl-[3-(2-oxo-1,3-benzoxazol-3-yl)propanoyl]amino]ethyl]phenyl]benzamide
CAS Name: N-[3-[(1S)-1-[methyl-[1-oxo-3-(2-oxo-1,3-benzoxazol-3-yl)propyl]amino]ethyl]phenyl]benzamide
IUPAC NAME: N-[3-[(1S)-1-[methyl-[3-(2-oxo-1,3-benzoxazol-3-yl)propanoyl]amino]ethyl]phenyl]benzamide
SYSTEMATIC NAME: N-[3-[(1S)-1-[methyl-[3-(2-oxidanylidene-1,3-benzoxazol-3-yl)propanoyl]amino]ethyl]phenyl]benzamide
MOLECULAR FORMULA: C26H25N3O4
MOLECULAR WEIGHT: 443.4944
SMILES: C[C@@H](C1=CC(=CC=C1)NC(=O)C2=CC=CC=C2)N(C)C(=O)CCN3C4=CC=CC=C4OC3=O
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Product OPENEYE NAME: (2S)-N-[(1R)-1-(3-benzamidophenyl)ethyl]-N-methyl-2,3-dihydrobenzofuran-2-carboxamide
CAS Name: (2S)-N-[(1R)-1-(3-benzamidophenyl)ethyl]-N-methyl-2,3-dihydrobenzofuran-2-carboxamide
IUPAC NAME: (2S)-N-[(1R)-1-(3-benzamidophenyl)ethyl]-N-methyl-2,3-dihydro-1-benzofuran-2-carboxamide
SYSTEMATIC NAME: (2S)-N-[(1R)-1-(3-benzamidophenyl)ethyl]-N-methyl-2,3-dihydro-1-benzofuran-2-carboxamide
MOLECULAR FORMULA: C25H24N2O3
MOLECULAR WEIGHT: 400.46966
SMILES: C[C@H](C1=CC(=CC=C1)NC(=O)C2=CC=CC=C2)N(C)C(=O)[C@@H]3CC4=CC=CC=C4O3
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Product OPENEYE NAME: (2S)-N-[(1S)-1-(3-benzamidophenyl)ethyl]-N-methyl-2,3-dihydrobenzofuran-2-carboxamide
CAS Name: (2S)-N-[(1S)-1-(3-benzamidophenyl)ethyl]-N-methyl-2,3-dihydrobenzofuran-2-carboxamide
IUPAC NAME: (2S)-N-[(1S)-1-(3-benzamidophenyl)ethyl]-N-methyl-2,3-dihydro-1-benzofuran-2-carboxamide
SYSTEMATIC NAME: (2S)-N-[(1S)-1-(3-benzamidophenyl)ethyl]-N-methyl-2,3-dihydro-1-benzofuran-2-carboxamide
MOLECULAR FORMULA: C25H24N2O3
MOLECULAR WEIGHT: 400.46966
SMILES: C[C@@H](C1=CC(=CC=C1)NC(=O)C2=CC=CC=C2)N(C)C(=O)[C@@H]3CC4=CC=CC=C4O3
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Product OPENEYE NAME: (2R)-N-[(1R)-1-(3-benzamidophenyl)ethyl]-N-methyl-2,3-dihydrobenzofuran-2-carboxamide
CAS Name: (2R)-N-[(1R)-1-(3-benzamidophenyl)ethyl]-N-methyl-2,3-dihydrobenzofuran-2-carboxamide
IUPAC NAME: (2R)-N-[(1R)-1-(3-benzamidophenyl)ethyl]-N-methyl-2,3-dihydro-1-benzofuran-2-carboxamide
SYSTEMATIC NAME: (2R)-N-[(1R)-1-(3-benzamidophenyl)ethyl]-N-methyl-2,3-dihydro-1-benzofuran-2-carboxamide
MOLECULAR FORMULA: C25H24N2O3
MOLECULAR WEIGHT: 400.46966
SMILES: C[C@H](C1=CC(=CC=C1)NC(=O)C2=CC=CC=C2)N(C)C(=O)[C@H]3CC4=CC=CC=C4O3
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Product OPENEYE NAME: (2R)-N-[(1S)-1-(3-benzamidophenyl)ethyl]-N-methyl-2,3-dihydrobenzofuran-2-carboxamide
CAS Name: (2R)-N-[(1S)-1-(3-benzamidophenyl)ethyl]-N-methyl-2,3-dihydrobenzofuran-2-carboxamide
IUPAC NAME: (2R)-N-[(1S)-1-(3-benzamidophenyl)ethyl]-N-methyl-2,3-dihydro-1-benzofuran-2-carboxamide
SYSTEMATIC NAME: (2R)-N-[(1S)-1-(3-benzamidophenyl)ethyl]-N-methyl-2,3-dihydro-1-benzofuran-2-carboxamide
MOLECULAR FORMULA: C25H24N2O3
MOLECULAR WEIGHT: 400.46966
SMILES: C[C@@H](C1=CC(=CC=C1)NC(=O)C2=CC=CC=C2)N(C)C(=O)[C@H]3CC4=CC=CC=C4O3
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Product OPENEYE NAME: 1-(m-tolyl)-6-oxo-N-[3-(phenylcarbamoylamino)phenyl]-4,5-dihydropyridazine-3-carboxamide
CAS Name: N-[3-[[anilino(oxo)methyl]amino]phenyl]-1-(3-methylphenyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide
IUPAC NAME: 1-(3-methylphenyl)-6-oxo-N-[3-(phenylcarbamoylamino)phenyl]-4,5-dihydropyridazine-3-carboxamide
SYSTEMATIC NAME: 1-(3-methylphenyl)-6-oxidanylidene-N-[3-(phenylcarbamoylamino)phenyl]-4,5-dihydropyridazine-3-carboxamide
MOLECULAR FORMULA: C25H23N5O3
MOLECULAR WEIGHT: 441.48182
SMILES: CC1=CC(=CC=C1)N2C(=O)CCC(=N2)C(=O)NC3=CC(=CC=C3)NC(=O)NC4=CC=CC=C4
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Product OPENEYE NAME: 2-bromo-5-fluoro-N-[3-(phenylcarbamoylamino)phenyl]benzamide
CAS Name: N-[3-[[anilino(oxo)methyl]amino]phenyl]-2-bromo-5-fluorobenzamide
IUPAC NAME: 2-bromo-5-fluoro-N-[3-(phenylcarbamoylamino)phenyl]benzamide
SYSTEMATIC NAME: 2-bromanyl-5-fluoranyl-N-[3-(phenylcarbamoylamino)phenyl]benzamide
MOLECULAR FORMULA: C20H15BrFN3O2
MOLECULAR WEIGHT: 428.254403
SMILES: C1=CC=C(C=C1)NC(=O)NC2=CC=CC(=C2)NC(=O)C3=C(C=CC(=C3)F)Br
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Product OPENEYE NAME: 3-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)-N-[3-(phenylcarbamoylamino)phenyl]propanamide
CAS Name: N-[3-[[anilino(oxo)methyl]amino]phenyl]-3-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)propanamide
IUPAC NAME: 3-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)-N-[3-(phenylcarbamoylamino)phenyl]propanamide
SYSTEMATIC NAME: 3-(6-chloranyl-2-oxidanylidene-1,3-benzoxazol-3-yl)-N-[3-(phenylcarbamoylamino)phenyl]propanamide
MOLECULAR FORMULA: C23H19ClN4O4
MOLECULAR WEIGHT: 450.87436
SMILES: C1=CC=C(C=C1)NC(=O)NC2=CC=CC(=C2)NC(=O)CCN3C4=C(C=C(C=C4)Cl)OC3=O
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Product OPENEYE NAME: N-[5-[2-(3-chloro-4-fluoro-anilino)-2-oxo-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-1-ethoxy-methanimidate
CAS Name: N-[5-[[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]-1-ethoxymethanimidate
IUPAC NAME: N-[5-[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-1-ethoxymethanimidate
SYSTEMATIC NAME: N-[5-[2-[(3-chloranyl-4-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-1-ethoxy-methanimidate
MOLECULAR FORMULA: C13H11ClFN4O3S2-
MOLECULAR WEIGHT: 389.832843
SMILES: CCOC(=NC1=NN=C(S1)SCC(=O)NC2=CC(=C(C=C2)F)Cl)[O-]
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Product OPENEYE NAME: ethyl N-[5-[2-(3-chloro-4-fluoro-anilino)-2-oxo-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]carbamate
CAS Name: N-[5-[[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]carbamic acid ethyl ester
IUPAC NAME: ethyl N-[5-[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]carbamate
SYSTEMATIC NAME: ethyl N-[5-[2-[(3-chloranyl-4-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]carbamate
MOLECULAR FORMULA: C13H12ClFN4O3S2
MOLECULAR WEIGHT: 390.840783
SMILES: CCOC(=O)NC1=NN=C(S1)SCC(=O)NC2=CC(=C(C=C2)F)Cl
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Product OPENEYE NAME: N-[5-[2-(3,4-dimethylanilino)-2-oxo-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-1-ethoxy-methanimidate
CAS Name: N-[5-[[2-(3,4-dimethylanilino)-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]-1-ethoxymethanimidate
IUPAC NAME: N-[5-[2-(3,4-dimethylanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-1-ethoxymethanimidate
SYSTEMATIC NAME: N-[5-[2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-1-ethoxy-methanimidate
MOLECULAR FORMULA: C15H17N4O3S2-
MOLECULAR WEIGHT: 365.45048
SMILES: CCOC(=NC1=NN=C(S1)SCC(=O)NC2=CC(=C(C=C2)C)C)[O-]
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Product OPENEYE NAME: ethyl N-[5-[2-(3,4-dimethylanilino)-2-oxo-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]carbamate
CAS Name: N-[5-[[2-(3,4-dimethylanilino)-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]carbamic acid ethyl ester
IUPAC NAME: ethyl N-[5-[2-(3,4-dimethylanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]carbamate
SYSTEMATIC NAME: ethyl N-[5-[2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]carbamate
MOLECULAR FORMULA: C15H18N4O3S2
MOLECULAR WEIGHT: 366.45842
SMILES: CCOC(=O)NC1=NN=C(S1)SCC(=O)NC2=CC(=C(C=C2)C)C
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Product OPENEYE NAME: 1-ethoxy-N-[5-[2-(4-isopropylanilino)-2-oxo-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]methanimidate
CAS Name: 1-ethoxy-N-[5-[[2-oxo-2-(4-propan-2-ylanilino)ethyl]thio]-1,3,4-thiadiazol-2-yl]methanimidate
IUPAC NAME: 1-ethoxy-N-[5-[2-oxo-2-(4-propan-2-ylanilino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]methanimidate
SYSTEMATIC NAME: 1-ethoxy-N-[5-[2-oxidanylidene-2-[(4-propan-2-ylphenyl)amino]ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]methanimidate
MOLECULAR FORMULA: C16H19N4O3S2-
MOLECULAR WEIGHT: 379.47706
SMILES: CCOC(=NC1=NN=C(S1)SCC(=O)NC2=CC=C(C=C2)C(C)C)[O-]
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Product OPENEYE NAME: ethyl N-[5-[2-(4-isopropylanilino)-2-oxo-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]carbamate
CAS Name: N-[5-[[2-oxo-2-(4-propan-2-ylanilino)ethyl]thio]-1,3,4-thiadiazol-2-yl]carbamic acid ethyl ester
IUPAC NAME: ethyl N-[5-[2-oxo-2-(4-propan-2-ylanilino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]carbamate
SYSTEMATIC NAME: ethyl N-[5-[2-oxidanylidene-2-[(4-propan-2-ylphenyl)amino]ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]carbamate
MOLECULAR FORMULA: C16H20N4O3S2
MOLECULAR WEIGHT: 380.485
SMILES: CCOC(=O)NC1=NN=C(S1)SCC(=O)NC2=CC=C(C=C2)C(C)C
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Product OPENEYE NAME: N-[5-[2-(1-adamantylamino)-2-oxo-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-1-ethoxy-methanimidate
CAS Name: N-[5-[[2-(1-adamantylamino)-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]-1-ethoxymethanimidate
IUPAC NAME: N-[5-[2-(1-adamantylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-1-ethoxymethanimidate
SYSTEMATIC NAME: N-[5-[2-(1-adamantylamino)-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-1-ethoxy-methanimidate
MOLECULAR FORMULA: C17H23N4O3S2-
MOLECULAR WEIGHT: 395.51952
SMILES: CCOC(=NC1=NN=C(S1)SCC(=O)NC23CC4CC(C2)CC(C4)C3)[O-]
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Product OPENEYE NAME: ethyl N-[5-[2-(1-adamantylamino)-2-oxo-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]carbamate
CAS Name: N-[5-[[2-(1-adamantylamino)-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]carbamic acid ethyl ester
IUPAC NAME: ethyl N-[5-[2-(1-adamantylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]carbamate
SYSTEMATIC NAME: ethyl N-[5-[2-(1-adamantylamino)-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]carbamate
MOLECULAR FORMULA: C17H24N4O3S2
MOLECULAR WEIGHT: 396.52746
SMILES: CCOC(=O)NC1=NN=C(S1)SCC(=O)NC23CC4CC(C2)CC(C4)C3
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Product OPENEYE NAME: N-[5-[2-[(4-chlorophenyl)methylamino]-2-oxo-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-1-ethoxy-methanimidate
CAS Name: N-[5-[[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]-1-ethoxymethanimidate
IUPAC NAME: N-[5-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-1-ethoxymethanimidate
SYSTEMATIC NAME: N-[5-[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-1-ethoxy-methanimidate
MOLECULAR FORMULA: C14H14ClN4O3S2-
MOLECULAR WEIGHT: 385.86896
SMILES: CCOC(=NC1=NN=C(S1)SCC(=O)NCC2=CC=C(C=C2)Cl)[O-]
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