5-[3-methyl-4-(2-methylphenyl)phenyl]carbonyl-N-(4-phenylbutyl)-6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepine-9-carboxamide

Systemtic Name: 5-[3-methyl-4-(2-methylphenyl)phenyl]carbonyl-N-(4-phenylbutyl)-6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepine-9-carboxamide Openeye Name: 5-[3-methyl-4-(o-tolyl)benzoyl]-N-(4-phenylbutyl)-6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepine-9-carboxamide CAS Name: 5-[[3-methyl-4-(2-methylphenyl)phenyl]-oxomethyl]-N-(4-phenylbutyl)-6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepine-9-carboxamide IUPAC Name: 5-[3-methyl-4-(2-methylphenyl)benzoyl]-N-(4-phenylbutyl)-6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepine-9-carboxamide Traditional Name: 5-[3-methyl-4-(o-tolyl)benzoyl]-N-(4-phenylbutyl)-6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepine-9-carboxamide Formula: C38H37N3O2 MolecularWeight: 567.71928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(C=C(C=C2)C(=O)N3CC4=CC=C(N4CC5=CC=CC=C53)C(=O)NCCCCC6=CC=CC=C6)C

Isomeric SMILES

CC1=CC=CC=C1C2=C(C=C(C=C2)C(=O)N3CC4=CC=C(N4CC5=CC=CC=C53)C(=O)NCCCCC6=CC=CC=C6)C

InChI

InChI=1S/C38H37N3O2/c1-27-12-6-8-17-33(27)34-21-19-30(24-28(34)2)38(43)41-26-32-20-22-36(40(32)25-31-16-7-9-18-35(31)41)37(42)39-23-11-10-15-29-13-4-3-5-14-29/h3-9,12-14,16-22,24H,10-11,15,23,25-26H2,1-2H3,(H,39,42)