2-[4-(dimethylamino)-5-(4-oxidanylidenebutyl)-1H-imidazol-2-yl]-1-(2-methylpropyl)-N-methylsulfonyl-N-phenyl-2,3-dihydro-1-benzazepine-4-carboxamide

Systemtic Name: 2-[4-(dimethylamino)-5-(4-oxidanylidenebutyl)-1H-imidazol-2-yl]-1-(2-methylpropyl)-N-methylsulfonyl-N-phenyl-2,3-dihydro-1-benzazepine-4-carboxamide Openeye Name: 2-[4-(dimethylamino)-5-(4-oxobutyl)-1H-imidazol-2-yl]-1-isobutyl-N-methylsulfonyl-N-phenyl-2,3-dihydro-1-benzazepine-4-carboxamide CAS Name: 2-[4-(dimethylamino)-5-(4-oxobutyl)-1H-imidazol-2-yl]-1-(2-methylpropyl)-N-methylsulfonyl-N-phenyl-2,3-dihydro-1-benzazepine-4-carboxamide IUPAC Name: 2-[4-(dimethylamino)-5-(4-oxobutyl)-1H-imidazol-2-yl]-1-(2-methylpropyl)-N-methylsulfonyl-N-phenyl-2,3-dihydro-1-benzazepine-4-carboxamide Traditional Name: 2-[4-(dimethylamino)-5-(4-ketobutyl)-1H-imidazol-2-yl]-1-isobutyl-N-mesyl-N-phenyl-2,3-dihydro-1-benzazepine-4-carboxamide Formula: C31H39N5O4S MolecularWeight: 577.73746

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(CC(=CC2=CC=CC=C21)C(=O)N(C3=CC=CC=C3)S(=O)(=O)C)C4=NC(=C(N4)CCCC=O)N(C)C

Isomeric SMILES

CC(C)CN1C(CC(=CC2=CC=CC=C21)C(=O)N(C3=CC=CC=C3)S(=O)(=O)C)C4=NC(=C(N4)CCCC=O)N(C)C

InChI

InChI=1S/C31H39N5O4S/c1-22(2)21-35-27-17-10-9-13-23(27)19-24(31(38)36(41(5,39)40)25-14-7-6-8-15-25)20-28(35)29-32-26(16-11-12-18-37)30(33-29)34(3)4/h6-10,13-15,17-19,22,28H,11-12,16,20-21H2,1-5H3,(H,32,33)