1-[3-chloranyl-6-(4-methylpiperazin-1-yl)benzo[b][1,4]benzodiazepin-11-yl]ethanone

Systemtic Name: 1-[3-chloranyl-6-(4-methylpiperazin-1-yl)benzo[b][1,4]benzodiazepin-11-yl]ethanone Openeye Name: 1-[3-chloro-6-(4-methylpiperazin-1-yl)benzo[b][1,4]benzodiazepin-11-yl]ethanone CAS Name: 1-[3-chloro-6-(4-methyl-1-piperazinyl)-11-benzo[b][1,4]benzodiazepinyl]ethanone IUPAC Name: 1-[3-chloro-6-(4-methylpiperazin-1-yl)benzo[b][1,4]benzodiazepin-11-yl]ethanone Traditional Name: 1-[3-chloro-6-(4-methylpiperazino)benzo[b][1,4]benzodiazepin-11-yl]ethanone Formula: C20H21ClN4O MolecularWeight: 368.85994

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C2=C(C=C(C=C2)Cl)N=C(C3=CC=CC=C31)N4CCN(CC4)C

Isomeric SMILES

CC(=O)N1C2=C(C=C(C=C2)Cl)N=C(C3=CC=CC=C31)N4CCN(CC4)C

InChI

InChI=1S/C20H21ClN4O/c1-14(26)25-18-6-4-3-5-16(18)20(24-11-9-23(2)10-12-24)22-17-13-15(21)7-8-19(17)25/h3-8,13H,9-12H2,1-2H3