N-[3-chloranyl-6-(4-methylpiperazin-1-yl)benzo[b][1,4]benzodiazepin-11-yl]-2-piperidin-1-yl-benzamide

Systemtic Name: N-[3-chloranyl-6-(4-methylpiperazin-1-yl)benzo[b][1,4]benzodiazepin-11-yl]-2-piperidin-1-yl-benzamide Openeye Name: N-[3-chloro-6-(4-methylpiperazin-1-yl)benzo[b][1,4]benzodiazepin-11-yl]-2-(1-piperidyl)benzamide CAS Name: N-[3-chloro-6-(4-methyl-1-piperazinyl)-11-benzo[b][1,4]benzodiazepinyl]-2-(1-piperidinyl)benzamide IUPAC Name: N-[3-chloro-6-(4-methylpiperazin-1-yl)benzo[b][1,4]benzodiazepin-11-yl]-2-piperidin-1-ylbenzamide Traditional Name: N-[3-chloro-6-(4-methylpiperazino)benzo[b][1,4]benzodiazepin-11-yl]-2-piperidino-benzamide Formula: C30H33ClN6O MolecularWeight: 529.07562

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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=CC=C5N6CCCCC6

Isomeric SMILES

CN1CCN(CC1)C2=NC3=C(C=CC(=C3)Cl)N(C4=CC=CC=C42)NC(=O)C5=CC=CC=C5N6CCCCC6

InChI

InChI=1S/C30H33ClN6O/c1-34-17-19-36(20-18-34)29-23-9-3-6-12-27(23)37(28-14-13-22(31)21-25(28)32-29)33-30(38)24-10-4-5-11-26(24)35-15-7-2-8-16-35/h3-6,9-14,21H,2,7-8,15-20H2,1H3,(H,33,38)