6-piperazin-1-yl-5H-benzo[b][1,4]benzodiazepine-3-carbonitrile

Systemtic Name: 6-piperazin-1-yl-5H-benzo[b][1,4]benzodiazepine-3-carbonitrile Openeye Name: 6-piperazin-1-yl-5H-benzo[b][1,4]benzodiazepine-3-carbonitrile CAS Name: 6-(1-piperazinyl)-5H-benzo[b][1,4]benzodiazepine-3-carbonitrile IUPAC Name: 6-piperazin-1-yl-5H-benzo[b][1,4]benzodiazepine-3-carbonitrile Traditional Name: 6-piperazino-5H-benzo[b][1,4]benzodiazepine-3-carbonitrile Formula: C18H17N5 MolecularWeight: 303.36108

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C3C=CC=CC3=NC4=C(N2)C=C(C=C4)C#N

Isomeric SMILES

C1CN(CCN1)C2=C3C=CC=CC3=NC4=C(N2)C=C(C=C4)C#N

InChI

InChI=1S/C18H17N5/c19-12-13-5-6-16-17(11-13)22-18(23-9-7-20-8-10-23)14-3-1-2-4-15(14)21-16/h1-6,11,20,22H,7-10H2