[4-(2-methoxyphenyl)-3-methyl-phenyl]-[9-(4-methylpiperazin-1-yl)carbonyl-6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepin-5-yl]methanone

Systemtic Name: [4-(2-methoxyphenyl)-3-methyl-phenyl]-[9-(4-methylpiperazin-1-yl)carbonyl-6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepin-5-yl]methanone Openeye Name: [4-(2-methoxyphenyl)-3-methyl-phenyl]-[9-(4-methylpiperazine-1-carbonyl)-6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepin-5-yl]methanone CAS Name: [4-(2-methoxyphenyl)-3-methylphenyl]-[9-[(4-methyl-1-piperazinyl)-oxomethyl]-6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepin-5-yl]methanone IUPAC Name: [4-(2-methoxyphenyl)-3-methylphenyl]-[9-(4-methylpiperazine-1-carbonyl)-6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepin-5-yl]methanone Traditional Name: [4-(2-methoxyphenyl)-3-methyl-phenyl]-[9-(4-methylpiperazine-1-carbonyl)-6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepin-5-yl]methanone Formula: C33H34N4O3 MolecularWeight: 534.64806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N2CC3=CC=C(N3CC4=CC=CC=C42)C(=O)N5CCN(CC5)C)C6=CC=CC=C6OC

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N2CC3=CC=C(N3CC4=CC=CC=C42)C(=O)N5CCN(CC5)C)C6=CC=CC=C6OC

InChI

InChI=1S/C33H34N4O3/c1-23-20-24(12-14-27(23)28-9-5-7-11-31(28)40-3)32(38)37-22-26-13-15-30(33(39)35-18-16-34(2)17-19-35)36(26)21-25-8-4-6-10-29(25)37/h4-15,20H,16-19,21-22H2,1-3H3