Saturday, June 1, 2013

All Chemical Compounds Information




Product OPENEYE NAME: N-[4-[[3-(3,5-dimethyl-1,1-dioxo-2H-1,2,6-thiadiazin-4-yl)propanoylamino]methyl]phenyl]furan-2-carboxamide
CAS Name: N-[4-[[[3-(3,5-dimethyl-1,1-dioxo-2H-1,2,6-thiadiazin-4-yl)-1-oxopropyl]amino]methyl]phenyl]-2-furancarboxamide
IUPAC NAME: N-[4-[[3-(3,5-dimethyl-1,1-dioxo-2H-1,2,6-thiadiazin-4-yl)propanoylamino]methyl]phenyl]furan-2-carboxamide
SYSTEMATIC NAME: N-[4-[[3-[3,5-dimethyl-1,1-bis(oxidanylidene)-2H-1,2,6-thiadiazin-4-yl]propanoylamino]methyl]phenyl]furan-2-carboxamide
MOLECULAR FORMULA: C20H22N4O5S
MOLECULAR WEIGHT: 430.47748
SMILES: CC1=C(C(=NS(=O)(=O)N1)C)CCC(=O)NCC2=CC=C(C=C2)NC(=O)C3=CC=CO3
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Product OPENEYE NAME: 1-[3-[(2S)-2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-3-oxo-propyl]pyrrolidine-2,5-dione
CAS Name: 1-[3-[(2S)-2-(3,4-dimethoxyphenyl)-1-pyrrolidinyl]-3-oxopropyl]pyrrolidine-2,5-dione
IUPAC NAME: 1-[3-[(2S)-2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-3-oxopropyl]pyrrolidine-2,5-dione
SYSTEMATIC NAME: 1-[3-[(2S)-2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-3-oxidanylidene-propyl]pyrrolidine-2,5-dione
MOLECULAR FORMULA: C19H24N2O5
MOLECULAR WEIGHT: 360.40426
SMILES: COC1=C(C=C(C=C1)[C@@H]2CCCN2C(=O)CCN3C(=O)CCC3=O)OC
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Product OPENEYE NAME: 1-[3-[(2R)-2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-3-oxo-propyl]pyrrolidine-2,5-dione
CAS Name: 1-[3-[(2R)-2-(3,4-dimethoxyphenyl)-1-pyrrolidinyl]-3-oxopropyl]pyrrolidine-2,5-dione
IUPAC NAME: 1-[3-[(2R)-2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-3-oxopropyl]pyrrolidine-2,5-dione
SYSTEMATIC NAME: 1-[3-[(2R)-2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-3-oxidanylidene-propyl]pyrrolidine-2,5-dione
MOLECULAR FORMULA: C19H24N2O5
MOLECULAR WEIGHT: 360.40426
SMILES: COC1=C(C=C(C=C1)[C@H]2CCCN2C(=O)CCN3C(=O)CCC3=O)OC
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Product OPENEYE NAME: 1-[(2R)-2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-2-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone
CAS Name: 1-[(2R)-2-(3,4-dimethoxyphenyl)-1-pyrrolidinyl]-2-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]thio]ethanone
IUPAC NAME: 1-[(2R)-2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-2-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone
SYSTEMATIC NAME: 1-[(2R)-2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-2-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone
MOLECULAR FORMULA: C23H25N3O5S
MOLECULAR WEIGHT: 455.5267
SMILES: COC1=CC=C(C=C1)C2=NN=C(O2)SCC(=O)N3CCC[C@@H]3C4=CC(=C(C=C4)OC)OC
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Product OPENEYE NAME: 1-[(2S)-2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-2-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone
CAS Name: 1-[(2S)-2-(3,4-dimethoxyphenyl)-1-pyrrolidinyl]-2-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]thio]ethanone
IUPAC NAME: 1-[(2S)-2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-2-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone
SYSTEMATIC NAME: 1-[(2S)-2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-2-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone
MOLECULAR FORMULA: C23H25N3O5S
MOLECULAR WEIGHT: 455.5267
SMILES: COC1=CC=C(C=C1)C2=NN=C(O2)SCC(=O)N3CCC[C@H]3C4=CC(=C(C=C4)OC)OC
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Product OPENEYE NAME: (E)-1-[(2S)-2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-3-[4-(dimethylamino)phenyl]prop-2-en-1-one
CAS Name: (E)-1-[(2S)-2-(3,4-dimethoxyphenyl)-1-pyrrolidinyl]-3-[4-(dimethylamino)phenyl]-2-propen-1-one
IUPAC NAME: (E)-1-[(2S)-2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-3-[4-(dimethylamino)phenyl]prop-2-en-1-one
SYSTEMATIC NAME: (E)-1-[(2S)-2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-3-[4-(dimethylamino)phenyl]prop-2-en-1-one
MOLECULAR FORMULA: C23H28N2O3
MOLECULAR WEIGHT: 380.48002
SMILES: CN(C)C1=CC=C(C=C1)/C=C/C(=O)N2CCC[C@H]2C3=CC(=C(C=C3)OC)OC
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Product OPENEYE NAME: (E)-1-[(2R)-2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-3-[4-(dimethylamino)phenyl]prop-2-en-1-one
CAS Name: (E)-1-[(2R)-2-(3,4-dimethoxyphenyl)-1-pyrrolidinyl]-3-[4-(dimethylamino)phenyl]-2-propen-1-one
IUPAC NAME: (E)-1-[(2R)-2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-3-[4-(dimethylamino)phenyl]prop-2-en-1-one
SYSTEMATIC NAME: (E)-1-[(2R)-2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-3-[4-(dimethylamino)phenyl]prop-2-en-1-one
MOLECULAR FORMULA: C23H28N2O3
MOLECULAR WEIGHT: 380.48002
SMILES: CN(C)C1=CC=C(C=C1)/C=C/C(=O)N2CCC[C@@H]2C3=CC(=C(C=C3)OC)OC
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Product OPENEYE NAME: 2-chloro-6-fluoro-N-[(4-ureidophenyl)methyl]benzamide
CAS Name: N-[[4-(carbamoylamino)phenyl]methyl]-2-chloro-6-fluorobenzamide
IUPAC NAME: N-[[4-(carbamoylamino)phenyl]methyl]-2-chloro-6-fluorobenzamide
SYSTEMATIC NAME: N-[[4-(aminocarbonylamino)phenyl]methyl]-2-chloranyl-6-fluoranyl-benzamide
MOLECULAR FORMULA: C15H13ClFN3O2
MOLECULAR WEIGHT: 321.734023
SMILES: C1=CC(=C(C(=C1)Cl)C(=O)NCC2=CC=C(C=C2)NC(=O)N)F
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Product OPENEYE NAME: 4-methyl-N-[(4-ureidophenyl)methyl]pentanamide
CAS Name: N-[[4-(carbamoylamino)phenyl]methyl]-4-methylpentanamide
IUPAC NAME: N-[[4-(carbamoylamino)phenyl]methyl]-4-methylpentanamide
SYSTEMATIC NAME: N-[[4-(aminocarbonylamino)phenyl]methyl]-4-methyl-pentanamide
MOLECULAR FORMULA: C14H21N3O2
MOLECULAR WEIGHT: 263.33544
SMILES: CC(C)CCC(=O)NCC1=CC=C(C=C1)NC(=O)N
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Product OPENEYE NAME: 2-methyl-2-phenyl-N-[(4-ureidophenyl)methyl]propanamide
CAS Name: N-[[4-(carbamoylamino)phenyl]methyl]-2-methyl-2-phenylpropanamide
IUPAC NAME: N-[[4-(carbamoylamino)phenyl]methyl]-2-methyl-2-phenylpropanamide
SYSTEMATIC NAME: N-[[4-(aminocarbonylamino)phenyl]methyl]-2-methyl-2-phenyl-propanamide
MOLECULAR FORMULA: C18H21N3O2
MOLECULAR WEIGHT: 311.37824
SMILES: CC(C)(C1=CC=CC=C1)C(=O)NCC2=CC=C(C=C2)NC(=O)N
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Product OPENEYE NAME: 6-[[4-(pyrrolidine-1-carbonyl)phenyl]methylcarbamoyl]pyridazin-3-olate
CAS Name: 6-[oxo-[[4-[oxo(1-pyrrolidinyl)methyl]phenyl]methylamino]methyl]-3-pyridazinolate
IUPAC NAME: 6-[[4-(pyrrolidine-1-carbonyl)phenyl]methylcarbamoyl]pyridazin-3-olate
SYSTEMATIC NAME: 6-[(4-pyrrolidin-1-ylcarbonylphenyl)methylcarbamoyl]pyridazin-3-olate
MOLECULAR FORMULA: C17H17N4O3-
MOLECULAR WEIGHT: 325.34188
SMILES: C1CCN(C1)C(=O)C2=CC=C(C=C2)CNC(=O)C3=NN=C(C=C3)[O-]
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Product OPENEYE NAME: 6-oxo-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]-1H-pyridazine-3-carboxamide
CAS Name: 6-oxo-N-[[4-[oxo(1-pyrrolidinyl)methyl]phenyl]methyl]-1H-pyridazine-3-carboxamide
IUPAC NAME: 6-oxo-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]-1H-pyridazine-3-carboxamide
SYSTEMATIC NAME: 6-oxidanylidene-N-[(4-pyrrolidin-1-ylcarbonylphenyl)methyl]-1H-pyridazine-3-carboxamide
MOLECULAR FORMULA: C17H18N4O3
MOLECULAR WEIGHT: 326.34982
SMILES: C1CCN(C1)C(=O)C2=CC=C(C=C2)CNC(=O)C3=NNC(=O)C=C3
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Product OPENEYE NAME: 6-[[4-(morpholine-4-carbonyl)phenyl]methylcarbamoyl]pyridazin-3-olate
CAS Name: 6-[[[4-[4-morpholinyl(oxo)methyl]phenyl]methylamino]-oxomethyl]-3-pyridazinolate
IUPAC NAME: 6-[[4-(morpholine-4-carbonyl)phenyl]methylcarbamoyl]pyridazin-3-olate
SYSTEMATIC NAME: 6-[(4-morpholin-4-ylcarbonylphenyl)methylcarbamoyl]pyridazin-3-olate
MOLECULAR FORMULA: C17H17N4O4-
MOLECULAR WEIGHT: 341.34128
SMILES: C1COCCN1C(=O)C2=CC=C(C=C2)CNC(=O)C3=NN=C(C=C3)[O-]
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Product OPENEYE NAME: N-[[4-(morpholine-4-carbonyl)phenyl]methyl]-6-oxo-1H-pyridazine-3-carboxamide
CAS Name: N-[[4-[4-morpholinyl(oxo)methyl]phenyl]methyl]-6-oxo-1H-pyridazine-3-carboxamide
IUPAC NAME: N-[[4-(morpholine-4-carbonyl)phenyl]methyl]-6-oxo-1H-pyridazine-3-carboxamide
SYSTEMATIC NAME: N-[(4-morpholin-4-ylcarbonylphenyl)methyl]-6-oxidanylidene-1H-pyridazine-3-carboxamide
MOLECULAR FORMULA: C17H18N4O4
MOLECULAR WEIGHT: 342.34922
SMILES: C1COCCN1C(=O)C2=CC=C(C=C2)CNC(=O)C3=NNC(=O)C=C3
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Product OPENEYE NAME: N-[[4-(morpholine-4-carbonyl)phenyl]methyl]-5-nitro-furan-2-carboxamide
CAS Name: N-[[4-[4-morpholinyl(oxo)methyl]phenyl]methyl]-5-nitro-2-furancarboxamide
IUPAC NAME: N-[[4-(morpholine-4-carbonyl)phenyl]methyl]-5-nitrofuran-2-carboxamide
SYSTEMATIC NAME: N-[(4-morpholin-4-ylcarbonylphenyl)methyl]-5-nitro-furan-2-carboxamide
MOLECULAR FORMULA: C17H17N3O6
MOLECULAR WEIGHT: 359.33338
SMILES: C1COCCN1C(=O)C2=CC=C(C=C2)CNC(=O)C3=CC=C(O3)[N+](=O)[O-]
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Product OPENEYE NAME: (3S)-N-[[4-(morpholine-4-carbonyl)phenyl]methyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide
CAS Name: (3S)-N-[[4-[4-morpholinyl(oxo)methyl]phenyl]methyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide
IUPAC NAME: (3S)-N-[[4-(morpholine-4-carbonyl)phenyl]methyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide
SYSTEMATIC NAME: (3S)-N-[(4-morpholin-4-ylcarbonylphenyl)methyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide
MOLECULAR FORMULA: C21H22N2O5
MOLECULAR WEIGHT: 382.40978
SMILES: C1COCCN1C(=O)C2=CC=C(C=C2)CNC(=O)[C@@H]3COC4=CC=CC=C4O3
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Product OPENEYE NAME: (3R)-N-[[4-(morpholine-4-carbonyl)phenyl]methyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide
CAS Name: (3R)-N-[[4-[4-morpholinyl(oxo)methyl]phenyl]methyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide
IUPAC NAME: (3R)-N-[[4-(morpholine-4-carbonyl)phenyl]methyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide
SYSTEMATIC NAME: (3R)-N-[(4-morpholin-4-ylcarbonylphenyl)methyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide
MOLECULAR FORMULA: C21H22N2O5
MOLECULAR WEIGHT: 382.40978
SMILES: C1COCCN1C(=O)C2=CC=C(C=C2)CNC(=O)[C@H]3COC4=CC=CC=C4O3
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Product OPENEYE NAME: 1-ethyl-N-[[4-(morpholine-4-carbonyl)phenyl]methyl]indole-3-carboxamide
CAS Name: 1-ethyl-N-[[4-[4-morpholinyl(oxo)methyl]phenyl]methyl]-3-indolecarboxamide
IUPAC NAME: 1-ethyl-N-[[4-(morpholine-4-carbonyl)phenyl]methyl]indole-3-carboxamide
SYSTEMATIC NAME: 1-ethyl-N-[(4-morpholin-4-ylcarbonylphenyl)methyl]indole-3-carboxamide
MOLECULAR FORMULA: C23H25N3O3
MOLECULAR WEIGHT: 391.4629
SMILES: CCN1C=C(C2=CC=CC=C21)C(=O)NCC3=CC=C(C=C3)C(=O)N4CCOCC4
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Product OPENEYE NAME: 2-chloro-6-fluoro-N-[[4-(morpholine-4-carbonyl)phenyl]methyl]benzamide
CAS Name: 2-chloro-6-fluoro-N-[[4-[4-morpholinyl(oxo)methyl]phenyl]methyl]benzamide
IUPAC NAME: 2-chloro-6-fluoro-N-[[4-(morpholine-4-carbonyl)phenyl]methyl]benzamide
SYSTEMATIC NAME: 2-chloranyl-6-fluoranyl-N-[(4-morpholin-4-ylcarbonylphenyl)methyl]benzamide
MOLECULAR FORMULA: C19H18ClFN2O3
MOLECULAR WEIGHT: 376.809223
SMILES: C1COCCN1C(=O)C2=CC=C(C=C2)CNC(=O)C3=C(C=CC=C3Cl)F
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Product OPENEYE NAME: 2-methyl-N-[[4-(morpholine-4-carbonyl)phenyl]methyl]-2-phenyl-propanamide
CAS Name: 2-methyl-N-[[4-[4-morpholinyl(oxo)methyl]phenyl]methyl]-2-phenylpropanamide
IUPAC NAME: 2-methyl-N-[[4-(morpholine-4-carbonyl)phenyl]methyl]-2-phenylpropanamide
SYSTEMATIC NAME: 2-methyl-N-[(4-morpholin-4-ylcarbonylphenyl)methyl]-2-phenyl-propanamide
MOLECULAR FORMULA: C22H26N2O3
MOLECULAR WEIGHT: 366.45344
SMILES: CC(C)(C1=CC=CC=C1)C(=O)NCC2=CC=C(C=C2)C(=O)N3CCOCC3
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