Saturday, June 1, 2013

All Chemical Compounds Information




Product OPENEYE NAME: (2R)-N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-2-(p-tolylsulfonylamino)propanamide
CAS Name: (2R)-N-[[2-(1-imidazolylmethyl)phenyl]methyl]-2-[(4-methylphenyl)sulfonylamino]propanamide
IUPAC NAME: (2R)-N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-2-[(4-methylphenyl)sulfonylamino]propanamide
SYSTEMATIC NAME: (2R)-N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-2-[(4-methylphenyl)sulfonylamino]propanamide
MOLECULAR FORMULA: C21H24N4O3S
MOLECULAR WEIGHT: 412.50526
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N[C@H](C)C(=O)NCC2=CC=CC=C2CN3C=CN=C3
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Product OPENEYE NAME: (2S)-N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-2-(p-tolylsulfonylamino)propanamide
CAS Name: (2S)-N-[[2-(1-imidazolylmethyl)phenyl]methyl]-2-[(4-methylphenyl)sulfonylamino]propanamide
IUPAC NAME: (2S)-N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-2-[(4-methylphenyl)sulfonylamino]propanamide
SYSTEMATIC NAME: (2S)-N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-2-[(4-methylphenyl)sulfonylamino]propanamide
MOLECULAR FORMULA: C21H24N4O3S
MOLECULAR WEIGHT: 412.50526
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](C)C(=O)NCC2=CC=CC=C2CN3C=CN=C3
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Product OPENEYE NAME: N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-4-(methylsulfamoyl)benzamide
CAS Name: N-[[2-(1-imidazolylmethyl)phenyl]methyl]-4-(methylsulfamoyl)benzamide
IUPAC NAME: N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-4-(methylsulfamoyl)benzamide
SYSTEMATIC NAME: N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-4-(methylsulfamoyl)benzamide
MOLECULAR FORMULA: C19H20N4O3S
MOLECULAR WEIGHT: 384.4521
SMILES: CNS(=O)(=O)C1=CC=C(C=C1)C(=O)NCC2=CC=CC=C2CN3C=CN=C3
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Product OPENEYE NAME: N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-4-(2-methoxyethylsulfamoyl)benzamide
CAS Name: N-[[2-(1-imidazolylmethyl)phenyl]methyl]-4-(2-methoxyethylsulfamoyl)benzamide
IUPAC NAME: N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-4-(2-methoxyethylsulfamoyl)benzamide
SYSTEMATIC NAME: N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-4-(2-methoxyethylsulfamoyl)benzamide
MOLECULAR FORMULA: C21H24N4O4S
MOLECULAR WEIGHT: 428.50466
SMILES: COCCNS(=O)(=O)C1=CC=C(C=C1)C(=O)NCC2=CC=CC=C2CN3C=CN=C3
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Product OPENEYE NAME: N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-2-methyl-5-(methylsulfamoyl)benzamide
CAS Name: N-[[2-(1-imidazolylmethyl)phenyl]methyl]-2-methyl-5-(methylsulfamoyl)benzamide
IUPAC NAME: N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-2-methyl-5-(methylsulfamoyl)benzamide
SYSTEMATIC NAME: N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-2-methyl-5-(methylsulfamoyl)benzamide
MOLECULAR FORMULA: C20H22N4O3S
MOLECULAR WEIGHT: 398.47868
SMILES: CC1=C(C=C(C=C1)S(=O)(=O)NC)C(=O)NCC2=CC=CC=C2CN3C=CN=C3
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Product OPENEYE NAME: N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-3-(p-tolyl)-1H-pyrazole-5-carboxamide
CAS Name: N-[[2-(1-imidazolylmethyl)phenyl]methyl]-3-(4-methylphenyl)-1H-pyrazole-5-carboxamide
IUPAC NAME: N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-3-(4-methylphenyl)-1H-pyrazole-5-carboxamide
SYSTEMATIC NAME: N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-3-(4-methylphenyl)-1H-pyrazole-5-carboxamide
MOLECULAR FORMULA: C22H21N5O
MOLECULAR WEIGHT: 371.43504
SMILES: CC1=CC=C(C=C1)C2=NNC(=C2)C(=O)NCC3=CC=CC=C3CN4C=CN=C4
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Product OPENEYE NAME: 2,4-difluoro-N-[3-[[2-(imidazol-1-ylmethyl)phenyl]methylamino]-3-oxo-propyl]benzamide
CAS Name: 2,4-difluoro-N-[3-[[2-(1-imidazolylmethyl)phenyl]methylamino]-3-oxopropyl]benzamide
IUPAC NAME: 2,4-difluoro-N-[3-[[2-(imidazol-1-ylmethyl)phenyl]methylamino]-3-oxopropyl]benzamide
SYSTEMATIC NAME: 2,4-bis(fluoranyl)-N-[3-[[2-(imidazol-1-ylmethyl)phenyl]methylamino]-3-oxidanylidene-propyl]benzamide
MOLECULAR FORMULA: C21H20F2N4O2
MOLECULAR WEIGHT: 398.405906
SMILES: C1=CC=C(C(=C1)CNC(=O)CCNC(=O)C2=C(C=C(C=C2)F)F)CN3C=CN=C3
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Product OPENEYE NAME: N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-2-oxo-1H-quinoline-3-carboxamide
CAS Name: N-[[2-(1-imidazolylmethyl)phenyl]methyl]-2-oxo-1H-quinoline-3-carboxamide
IUPAC NAME: N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-2-oxo-1H-quinoline-3-carboxamide
SYSTEMATIC NAME: N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-2-oxidanylidene-1H-quinoline-3-carboxamide
MOLECULAR FORMULA: C21H18N4O2
MOLECULAR WEIGHT: 358.39322
SMILES: C1=CC=C2C(=C1)C=C(C(=O)N2)C(=O)NCC3=CC=CC=C3CN4C=CN=C4
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Product OPENEYE NAME: 1-(4-fluorophenyl)-N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-2,5-dimethyl-pyrrole-3-carboxamide
CAS Name: 1-(4-fluorophenyl)-N-[[2-(1-imidazolylmethyl)phenyl]methyl]-2,5-dimethyl-3-pyrrolecarboxamide
IUPAC NAME: 1-(4-fluorophenyl)-N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-2,5-dimethylpyrrole-3-carboxamide
SYSTEMATIC NAME: 1-(4-fluorophenyl)-N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-2,5-dimethyl-pyrrole-3-carboxamide
MOLECULAR FORMULA: C24H23FN4O
MOLECULAR WEIGHT: 402.464023
SMILES: CC1=CC(=C(N1C2=CC=C(C=C2)F)C)C(=O)NCC3=CC=CC=C3CN4C=CN=C4
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Product OPENEYE NAME: [6-(2-fluorophenyl)-3-methyl-isoxazolo[5,4-b]pyridin-4-yl]-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)-1-piperidyl]methanone
CAS Name: [6-(2-fluorophenyl)-3-methyl-4-isoxazolo[5,4-b]pyridinyl]-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)-1-piperidinyl]methanone
IUPAC NAME: [6-(2-fluorophenyl)-3-methyl-[1,2]oxazolo[5,4-b]pyridin-4-yl]-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]methanone
SYSTEMATIC NAME: [6-(2-fluorophenyl)-3-methyl-[1,2]oxazolo[5,4-b]pyridin-4-yl]-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]methanone
MOLECULAR FORMULA: C25H21FN6O2
MOLECULAR WEIGHT: 456.471643
SMILES: CC1=NOC2=C1C(=CC(=N2)C3=CC=CC=C3F)C(=O)N4CCC(CC4)C5=NN=C6N5C=CC=C6
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Product OPENEYE NAME: 2-bromo-N-[(1-phenylcyclopentyl)methyl]-5-sulfamoyl-benzamide
CAS Name: 2-bromo-N-[(1-phenylcyclopentyl)methyl]-5-sulfamoylbenzamide
IUPAC NAME: 2-bromo-N-[(1-phenylcyclopentyl)methyl]-5-sulfamoylbenzamide
SYSTEMATIC NAME: 2-bromanyl-N-[(1-phenylcyclopentyl)methyl]-5-sulfamoyl-benzamide
MOLECULAR FORMULA: C19H21BrN2O3S
MOLECULAR WEIGHT: 437.35064
SMILES: C1CCC(C1)(CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N)Br)C3=CC=CC=C3
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Product OPENEYE NAME: [4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]-(5-methylpyrazin-2-yl)methanone
CAS Name: [4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]-(5-methyl-2-pyrazinyl)methanone
IUPAC NAME: [4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]-(5-methylpyrazin-2-yl)methanone
SYSTEMATIC NAME: [4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]-(5-methylpyrazin-2-yl)methanone
MOLECULAR FORMULA: C19H18N4O
MOLECULAR WEIGHT: 318.37242
SMILES: CC1=NC=C(N=C1)C(=O)N2CCC(=CC2)C3=CNC4=CC=CC=C43
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Product OPENEYE NAME: 1-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]-2,2-dimethyl-propan-1-one
CAS Name: 1-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]-2,2-dimethyl-1-propanone
IUPAC NAME: 1-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]-2,2-dimethylpropan-1-one
SYSTEMATIC NAME: 1-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]-2,2-dimethyl-propan-1-one
MOLECULAR FORMULA: C18H22N2O
MOLECULAR WEIGHT: 282.38008
SMILES: CC(C)(C)C(=O)N1CCC(=CC1)C2=CNC3=CC=CC=C32
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Product OPENEYE NAME: (2-chloro-6-fluoro-phenyl)-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone
CAS Name: (2-chloro-6-fluorophenyl)-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone
IUPAC NAME: (2-chloro-6-fluorophenyl)-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone
SYSTEMATIC NAME: (2-chloranyl-6-fluoranyl-phenyl)-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone
MOLECULAR FORMULA: C20H16ClFN2O
MOLECULAR WEIGHT: 354.805243
SMILES: C1CN(CC=C1C2=CNC3=CC=CC=C32)C(=O)C4=C(C=CC=C4Cl)F
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Product OPENEYE NAME: (2,6-difluorophenyl)-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone
CAS Name: (2,6-difluorophenyl)-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone
IUPAC NAME: (2,6-difluorophenyl)-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone
SYSTEMATIC NAME: [2,6-bis(fluoranyl)phenyl]-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone
MOLECULAR FORMULA: C20H16F2N2O
MOLECULAR WEIGHT: 338.350646
SMILES: C1CN(CC=C1C2=CNC3=CC=CC=C32)C(=O)C4=C(C=CC=C4F)F
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Product OPENEYE NAME: [(3R)-2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl]-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone
CAS Name: [(3R)-2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl]-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone
IUPAC NAME: [(3R)-2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl]-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone
SYSTEMATIC NAME: [(3R)-2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl]-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone
MOLECULAR FORMULA: C25H27N3O3S
MOLECULAR WEIGHT: 449.56518
SMILES: CCS(=O)(=O)N1CC2=CC=CC=C2C[C@@H]1C(=O)N3CCC(=CC3)C4=CNC5=CC=CC=C54
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Product OPENEYE NAME: [(3S)-2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl]-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone
CAS Name: [(3S)-2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl]-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone
IUPAC NAME: [(3S)-2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl]-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone
SYSTEMATIC NAME: [(3S)-2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl]-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone
MOLECULAR FORMULA: C25H27N3O3S
MOLECULAR WEIGHT: 449.56518
SMILES: CCS(=O)(=O)N1CC2=CC=CC=C2C[C@H]1C(=O)N3CCC(=CC3)C4=CNC5=CC=CC=C54
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Product OPENEYE NAME: [2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]phenyl]-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone
CAS Name: [2-[(3,5-dimethyl-4-isoxazolyl)methylthio]phenyl]-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone
IUPAC NAME: [2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]phenyl]-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone
SYSTEMATIC NAME: [2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]phenyl]-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone
MOLECULAR FORMULA: C26H25N3O2S
MOLECULAR WEIGHT: 443.5606
SMILES: CC1=C(C(=NO1)C)CSC2=CC=CC=C2C(=O)N3CCC(=CC3)C4=CNC5=CC=CC=C54
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Product OPENEYE NAME: 1-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]-2-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone
CAS Name: 1-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]-2-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]thio]ethanone
IUPAC NAME: 1-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]-2-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone
SYSTEMATIC NAME: 1-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]-2-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone
MOLECULAR FORMULA: C24H22N4O3S
MOLECULAR WEIGHT: 446.52148
SMILES: COC1=CC=C(C=C1)C2=NN=C(O2)SCC(=O)N3CCC(=CC3)C4=CNC5=CC=CC=C54
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Product OPENEYE NAME: [2-[(3,5-dimethylisoxazol-4-yl)methoxy]phenyl]-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone
CAS Name: [2-[(3,5-dimethyl-4-isoxazolyl)methoxy]phenyl]-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone
IUPAC NAME: [2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone
SYSTEMATIC NAME: [2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone
MOLECULAR FORMULA: C26H25N3O3
MOLECULAR WEIGHT: 427.495
SMILES: CC1=C(C(=NO1)C)COC2=CC=CC=C2C(=O)N3CCC(=CC3)C4=CNC5=CC=CC=C54
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Product OPENEYE NAME: (3S)-3-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridine-1-carbonyl]-3-methyl-isochroman-1-one
CAS Name: (3S)-3-[[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]-oxomethyl]-3-methyl-3,4-dihydro-1H-2-benzopyran-1-one
IUPAC NAME: (3S)-3-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridine-1-carbonyl]-3-methyl-4H-isochromen-1-one
SYSTEMATIC NAME: (3S)-3-[[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]carbonyl]-3-methyl-4H-isochromen-1-one
MOLECULAR FORMULA: C24H22N2O3
MOLECULAR WEIGHT: 386.44308
SMILES: C[C@]1(CC2=CC=CC=C2C(=O)O1)C(=O)N3CCC(=CC3)C4=CNC5=CC=CC=C54
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Product OPENEYE NAME: (3R)-3-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridine-1-carbonyl]-3-methyl-isochroman-1-one
CAS Name: (3R)-3-[[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]-oxomethyl]-3-methyl-3,4-dihydro-1H-2-benzopyran-1-one
IUPAC NAME: (3R)-3-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridine-1-carbonyl]-3-methyl-4H-isochromen-1-one
SYSTEMATIC NAME: (3R)-3-[[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]carbonyl]-3-methyl-4H-isochromen-1-one
MOLECULAR FORMULA: C24H22N2O3
MOLECULAR WEIGHT: 386.44308
SMILES: C[C@@]1(CC2=CC=CC=C2C(=O)O1)C(=O)N3CCC(=CC3)C4=CNC5=CC=CC=C54
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Product OPENEYE NAME: (E)-3-[4-(dimethylamino)phenyl]-1-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]prop-2-en-1-one
CAS Name: (E)-3-[4-(dimethylamino)phenyl]-1-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]-2-propen-1-one
IUPAC NAME: (E)-3-[4-(dimethylamino)phenyl]-1-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]prop-2-en-1-one
SYSTEMATIC NAME: (E)-3-[4-(dimethylamino)phenyl]-1-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]prop-2-en-1-one
MOLECULAR FORMULA: C24H25N3O
MOLECULAR WEIGHT: 371.4748
SMILES: CN(C)C1=CC=C(C=C1)/C=C/C(=O)N2CCC(=CC2)C3=CNC4=CC=CC=C43
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Product OPENEYE NAME: [1-(1,3-benzothiazol-2-ylmethyl)cyclopentyl]-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone
CAS Name: [1-(1,3-benzothiazol-2-ylmethyl)cyclopentyl]-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone
IUPAC NAME: [1-(1,3-benzothiazol-2-ylmethyl)cyclopentyl]-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone
SYSTEMATIC NAME: [1-(1,3-benzothiazol-2-ylmethyl)cyclopentyl]-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone
MOLECULAR FORMULA: C27H27N3OS
MOLECULAR WEIGHT: 441.58778
SMILES: C1CCC(C1)(CC2=NC3=CC=CC=C3S2)C(=O)N4CCC(=CC4)C5=CNC6=CC=CC=C65
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