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

Systemtic Name: 4-bromanyl-N-[3-chloranyl-6-(4-methylpiperazin-1-yl)benzo[b][1,4]benzodiazepin-11-yl]benzamide Openeye Name: 4-bromo-N-[3-chloro-6-(4-methylpiperazin-1-yl)benzo[b][1,4]benzodiazepin-11-yl]benzamide CAS Name: 4-bromo-N-[3-chloro-6-(4-methyl-1-piperazinyl)-11-benzo[b][1,4]benzodiazepinyl]benzamide IUPAC Name: 4-bromo-N-[3-chloro-6-(4-methylpiperazin-1-yl)benzo[b][1,4]benzodiazepin-11-yl]benzamide Traditional Name: 4-bromo-N-[3-chloro-6-(4-methylpiperazino)benzo[b][1,4]benzodiazepin-11-yl]benzamide Formula: C25H23BrClN5O MolecularWeight: 524.84002

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC3=C(C=CC(=C3)Cl)N(C4=CC=CC=C42)NC(=O)C5=CC=C(C=C5)Br

Isomeric SMILES

CN1CCN(CC1)C2=NC3=C(C=CC(=C3)Cl)N(C4=CC=CC=C42)NC(=O)C5=CC=C(C=C5)Br

InChI

InChI=1S/C25H23BrClN5O/c1-30-12-14-31(15-13-30)24-20-4-2-3-5-22(20)32(23-11-10-19(27)16-21(23)28-24)29-25(33)17-6-8-18(26)9-7-17/h2-11,16H,12-15H2,1H3,(H,29,33)