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

Systemtic Name: 4-methyl-2-[[4-[(2-methylphenyl)methyl]piperazin-1-yl]methyl]-1,2,4-triazole-3-thione Openeye Name: 4-methyl-2-[[4-(o-tolylmethyl)piperazin-1-yl]methyl]-1,2,4-triazole-3-thione CAS Name: 4-methyl-2-[[4-[(2-methylphenyl)methyl]-1-piperazinyl]methyl]-1,2,4-triazole-3-thione IUPAC Name: 4-methyl-2-[[4-[(2-methylphenyl)methyl]piperazin-1-yl]methyl]-1,2,4-triazole-3-thione Traditional Name: 4-methyl-2-[[4-(2-methylbenzyl)piperazino]methyl]-1,2,4-triazole-3-thione Formula: C16H23N5S MolecularWeight: 317.45232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCN(CC2)CN3C(=S)N(C=N3)C

Isomeric SMILES

CC1=CC=CC=C1CN2CCN(CC2)CN3C(=S)N(C=N3)C

InChI

InChI=1S/C16H23N5S/c1-14-5-3-4-6-15(14)11-19-7-9-20(10-8-19)13-21-16(22)18(2)12-17-21/h3-6,12H,7-11,13H2,1-2H3