3-chloranyl-6-(4-phenethylpiperazin-1-yl)-5H-benzo[b][1,4]benzodiazepine

Systemtic Name: 3-chloranyl-6-(4-phenethylpiperazin-1-yl)-5H-benzo[b][1,4]benzodiazepine Openeye Name: 3-chloro-6-(4-phenethylpiperazin-1-yl)-5H-benzo[b][1,4]benzodiazepine CAS Name: 3-chloro-6-(4-phenethyl-1-piperazinyl)-5H-benzo[b][1,4]benzodiazepine IUPAC Name: 3-chloro-6-(4-phenethylpiperazin-1-yl)-5H-benzo[b][1,4]benzodiazepine Traditional Name: 3-chloro-6-(4-phenethylpiperazino)-5H-benzo[b][1,4]benzodiazepine Formula: C25H25ClN4 MolecularWeight: 416.9458

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=CC=CC=C2)C3=C4C=CC=CC4=NC5=C(N3)C=C(C=C5)Cl

Isomeric SMILES

C1CN(CCN1CCC2=CC=CC=C2)C3=C4C=CC=CC4=NC5=C(N3)C=C(C=C5)Cl

InChI

InChI=1S/C25H25ClN4/c26-20-10-11-23-24(18-20)28-25(21-8-4-5-9-22(21)27-23)30-16-14-29(15-17-30)13-12-19-6-2-1-3-7-19/h1-11,18,28H,12-17H2