4-(2-methylphenyl)-3-[(4-methylpiperazin-1-yl)methyl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(2-methylphenyl)-3-[(4-methylpiperazin-1-yl)methyl]-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(4-methylpiperazin-1-yl)methyl]-4-(o-tolyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-(2-methylphenyl)-3-[(4-methyl-1-piperazinyl)methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(2-methylphenyl)-3-[(4-methylpiperazin-1-yl)methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 3-[(4-methylpiperazino)methyl]-4-(o-tolyl)-1H-1,2,4-triazole-5-thione Formula: C15H21N5S MolecularWeight: 303.42574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=NNC2=S)CN3CCN(CC3)C

Isomeric SMILES

CC1=CC=CC=C1N2C(=NNC2=S)CN3CCN(CC3)C

InChI

InChI=1S/C15H21N5S/c1-12-5-3-4-6-13(12)20-14(16-17-15(20)21)11-19-9-7-18(2)8-10-19/h3-6H,7-11H2,1-2H3,(H,17,21)