5-(2-methylphenyl)-2-(phenylmethyl)-1H-1,2,4-triazole-3-thione

Systemtic Name: 5-(2-methylphenyl)-2-(phenylmethyl)-1H-1,2,4-triazole-3-thione Openeye Name: 2-benzyl-5-(o-tolyl)-1H-1,2,4-triazole-3-thione CAS Name: 5-(2-methylphenyl)-2-(phenylmethyl)-1H-1,2,4-triazole-3-thione IUPAC Name: 2-benzyl-5-(2-methylphenyl)-1H-1,2,4-triazole-3-thione Traditional Name: 2-benzyl-5-(o-tolyl)-1H-1,2,4-triazole-3-thione Formula: C16H15N3S MolecularWeight: 281.3754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC(=S)N(N2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1C2=NC(=S)N(N2)CC3=CC=CC=C3

InChI

InChI=1S/C16H15N3S/c1-12-7-5-6-10-14(12)15-17-16(20)19(18-15)11-13-8-3-2-4-9-13/h2-10H,11H2,1H3,(H,17,18,20)