5-[4-(3-chlorophenyl)piperazin-1-yl]-2-(4-methylphenyl)-1,2,3-triazole-4-carbonitrile

Systemtic Name: 5-[4-(3-chlorophenyl)piperazin-1-yl]-2-(4-methylphenyl)-1,2,3-triazole-4-carbonitrile Openeye Name: 5-[4-(3-chlorophenyl)piperazin-1-yl]-2-(p-tolyl)triazole-4-carbonitrile CAS Name: 5-[4-(3-chlorophenyl)-1-piperazinyl]-2-(4-methylphenyl)-4-triazolecarbonitrile IUPAC Name: 5-[4-(3-chlorophenyl)piperazin-1-yl]-2-(4-methylphenyl)triazole-4-carbonitrile Traditional Name: 5-[4-(3-chlorophenyl)piperazino]-2-(p-tolyl)triazole-4-carbonitrile Formula: C20H19ClN6 MolecularWeight: 378.85806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2N=C(C(=N2)N3CCN(CC3)C4=CC(=CC=C4)Cl)C#N

Isomeric SMILES

CC1=CC=C(C=C1)N2N=C(C(=N2)N3CCN(CC3)C4=CC(=CC=C4)Cl)C#N

InChI

InChI=1S/C20H19ClN6/c1-15-5-7-17(8-6-15)27-23-19(14-22)20(24-27)26-11-9-25(10-12-26)18-4-2-3-16(21)13-18/h2-8,13H,9-12H2,1H3