2-(cyclopropylamino)-11-[4-(4-fluorophenyl)piperazin-1-yl]-7-propan-2-yl-7,13-dihydrobenzimidazolo[1,2-d][1,4]benzodiazepin-6-one

Systemtic Name: 2-(cyclopropylamino)-11-[4-(4-fluorophenyl)piperazin-1-yl]-7-propan-2-yl-7,13-dihydrobenzimidazolo[1,2-d][1,4]benzodiazepin-6-one Openeye Name: 2-(cyclopropylamino)-11-[4-(4-fluorophenyl)piperazin-1-yl]-7-isopropyl-7,13-dihydrobenzimidazolo[1,2-d][1,4]benzodiazepin-6-one CAS Name: 2-(cyclopropylamino)-11-[4-(4-fluorophenyl)-1-piperazinyl]-7-propan-2-yl-7,13-dihydrobenzimidazolo[1,2-d][1,4]benzodiazepin-6-one IUPAC Name: 2-(cyclopropylamino)-11-[4-(4-fluorophenyl)piperazin-1-yl]-7-propan-2-yl-7,13-dihydrobenzimidazolo[1,2-d][1,4]benzodiazepin-6-one Traditional Name: 2-(cyclopropylamino)-11-[4-(4-fluorophenyl)piperazino]-7-isopropyl-7,13-dihydrobenzimidazolo[1,2-d][1,4]benzodiazepin-6-one Formula: C31H33FN6O MolecularWeight: 524.631723

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=O)N=C2C=CC(=CC2=C3N1C4=C(N3)C=C(C=C4)N5CCN(CC5)C6=CC=C(C=C6)F)NC7CC7

Isomeric SMILES

CC(C)C1C(=O)N=C2C=CC(=CC2=C3N1C4=C(N3)C=C(C=C4)N5CCN(CC5)C6=CC=C(C=C6)F)NC7CC7

InChI

InChI=1S/C31H33FN6O/c1-19(2)29-31(39)35-26-11-7-22(33-21-5-6-21)17-25(26)30-34-27-18-24(10-12-28(27)38(29)30)37-15-13-36(14-16-37)23-8-3-20(32)4-9-23/h3-4,7-12,17-19,21,29,33-34H,5-6,13-16H2,1-2H3