5-[(4-chlorophenyl)methyl]-4-(2-methylphenyl)-1,2,4-triazole-3-thiolate

Systemtic Name: 5-[(4-chlorophenyl)methyl]-4-(2-methylphenyl)-1,2,4-triazole-3-thiolate Openeye Name: 5-[(4-chlorophenyl)methyl]-4-(o-tolyl)-1,2,4-triazole-3-thiolate CAS Name: 5-[(4-chlorophenyl)methyl]-4-(2-methylphenyl)-1,2,4-triazole-3-thiolate IUPAC Name: 5-[(4-chlorophenyl)methyl]-4-(2-methylphenyl)-1,2,4-triazole-3-thiolate Traditional Name: 5-(4-chlorobenzyl)-4-(o-tolyl)-1,2,4-triazole-3-thiolate Formula: C16H13ClN3S- MolecularWeight: 314.81252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=NN=C2[S-])CC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=CC=C1N2C(=NN=C2[S-])CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H14ClN3S/c1-11-4-2-3-5-14(11)20-15(18-19-16(20)21)10-12-6-8-13(17)9-7-12/h2-9H,10H2,1H3,(H,19,21)/p-1