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

Systemtic Name: N-[3-chloranyl-6-(4-methylpiperazin-1-yl)benzo[b][1,4]benzodiazepin-11-yl]-3-piperidin-1-yl-propanamide Openeye Name: N-[3-chloro-6-(4-methylpiperazin-1-yl)benzo[b][1,4]benzodiazepin-11-yl]-3-(1-piperidyl)propanamide CAS Name: N-[3-chloro-6-(4-methyl-1-piperazinyl)-11-benzo[b][1,4]benzodiazepinyl]-3-(1-piperidinyl)propanamide IUPAC Name: N-[3-chloro-6-(4-methylpiperazin-1-yl)benzo[b][1,4]benzodiazepin-11-yl]-3-piperidin-1-ylpropanamide Traditional Name: N-[3-chloro-6-(4-methylpiperazino)benzo[b][1,4]benzodiazepin-11-yl]-3-piperidino-propionamide Formula: C26H33ClN6O MolecularWeight: 481.03282

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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)CCN5CCCCC5

Isomeric SMILES

CN1CCN(CC1)C2=NC3=C(C=CC(=C3)Cl)N(C4=CC=CC=C42)NC(=O)CCN5CCCCC5

InChI

InChI=1S/C26H33ClN6O/c1-30-15-17-32(18-16-30)26-21-7-3-4-8-23(21)33(24-10-9-20(27)19-22(24)28-26)29-25(34)11-14-31-12-5-2-6-13-31/h3-4,7-10,19H,2,5-6,11-18H2,1H3,(H,29,34)