9-methyl-6-(3-phenethylpiperazin-1-yl)-11H-benzo[b][1,4]benzodiazepine

Systemtic Name: 9-methyl-6-(3-phenethylpiperazin-1-yl)-11H-benzo[b][1,4]benzodiazepine Openeye Name: 9-methyl-6-(3-phenethylpiperazin-1-yl)-11H-benzo[b][1,4]benzodiazepine CAS Name: 9-methyl-6-(3-phenethyl-1-piperazinyl)-11H-benzo[b][1,4]benzodiazepine IUPAC Name: 9-methyl-6-(3-phenethylpiperazin-1-yl)-11H-benzo[b][1,4]benzodiazepine Traditional Name: 9-methyl-6-(3-phenethylpiperazino)-11H-benzo[b][1,4]benzodiazepine Formula: C26H28N4 MolecularWeight: 396.52732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=NC3=CC=CC=C3N2)N4CCNC(C4)CCC5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)C(=NC3=CC=CC=C3N2)N4CCNC(C4)CCC5=CC=CC=C5

InChI

InChI=1S/C26H28N4/c1-19-11-14-22-25(17-19)28-23-9-5-6-10-24(23)29-26(22)30-16-15-27-21(18-30)13-12-20-7-3-2-4-8-20/h2-11,14,17,21,27-28H,12-13,15-16,18H2,1H3