1-[[4-(2-methylphenyl)piperazin-1-ium-1-yl]methyl]-4-phenyl-1,2,3,4-tetrazole-5-thione

Systemtic Name: 1-[[4-(2-methylphenyl)piperazin-1-ium-1-yl]methyl]-4-phenyl-1,2,3,4-tetrazole-5-thione Openeye Name: 1-[[4-(o-tolyl)piperazin-1-ium-1-yl]methyl]-4-phenyl-tetrazole-5-thione CAS Name: 1-[[4-(2-methylphenyl)-1-piperazin-1-iumyl]methyl]-4-phenyl-5-tetrazolethione IUPAC Name: 1-[[4-(2-methylphenyl)piperazin-1-ium-1-yl]methyl]-4-phenyltetrazole-5-thione Traditional Name: 1-[[4-(o-tolyl)piperazin-1-ium-1-yl]methyl]-4-phenyl-tetrazole-5-thione Formula: C19H23N6S+ MolecularWeight: 367.49112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CC[NH+](CC2)CN3C(=S)N(N=N3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1N2CC[NH+](CC2)CN3C(=S)N(N=N3)C4=CC=CC=C4

InChI

InChI=1S/C19H22N6S/c1-16-7-5-6-10-18(16)23-13-11-22(12-14-23)15-24-19(26)25(21-20-24)17-8-3-2-4-9-17/h2-10H,11-15H2,1H3/p+1