4-ethyl-2-[[4-(3-methylphenyl)piperazin-1-ium-1-yl]methyl]-1,2,4-triazole-3-thione

Systemtic Name: 4-ethyl-2-[[4-(3-methylphenyl)piperazin-1-ium-1-yl]methyl]-1,2,4-triazole-3-thione Openeye Name: 4-ethyl-2-[[4-(m-tolyl)piperazin-1-ium-1-yl]methyl]-1,2,4-triazole-3-thione CAS Name: 4-ethyl-2-[[4-(3-methylphenyl)-1-piperazin-1-iumyl]methyl]-1,2,4-triazole-3-thione IUPAC Name: 4-ethyl-2-[[4-(3-methylphenyl)piperazin-1-ium-1-yl]methyl]-1,2,4-triazole-3-thione Traditional Name: 4-ethyl-2-[[4-(m-tolyl)piperazin-1-ium-1-yl]methyl]-1,2,4-triazole-3-thione Formula: C16H24N5S+ MolecularWeight: 318.46026

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NN(C1=S)C[NH+]2CCN(CC2)C3=CC=CC(=C3)C

Isomeric SMILES

CCN1C=NN(C1=S)C[NH+]2CCN(CC2)C3=CC=CC(=C3)C

InChI

InChI=1S/C16H23N5S/c1-3-19-12-17-21(16(19)22)13-18-7-9-20(10-8-18)15-6-4-5-14(2)11-15/h4-6,11-12H,3,7-10,13H2,1-2H3/p+1