2-(4-methylphenyl)-4-(4-methylpiperazin-1-yl)-3H-1,5-benzodiazepine

Systemtic Name: 2-(4-methylphenyl)-4-(4-methylpiperazin-1-yl)-3H-1,5-benzodiazepine Openeye Name: 4-(4-methylpiperazin-1-yl)-2-(p-tolyl)-3H-1,5-benzodiazepine CAS Name: 2-(4-methylphenyl)-4-(4-methyl-1-piperazinyl)-3H-1,5-benzodiazepine IUPAC Name: 2-(4-methylphenyl)-4-(4-methylpiperazin-1-yl)-3H-1,5-benzodiazepine Traditional Name: 4-(4-methylpiperazino)-2-(p-tolyl)-3H-1,5-benzodiazepine Formula: C21H24N4 MolecularWeight: 332.44206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3N=C(C2)N4CCN(CC4)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3N=C(C2)N4CCN(CC4)C

InChI

InChI=1S/C21H24N4/c1-16-7-9-17(10-8-16)20-15-21(25-13-11-24(2)12-14-25)23-19-6-4-3-5-18(19)22-20/h3-10H,11-15H2,1-2H3