4-(2-methylphenyl)-5-(4-methylphenyl)-1,2,4-triazole-3-thiolate

Systemtic Name: 4-(2-methylphenyl)-5-(4-methylphenyl)-1,2,4-triazole-3-thiolate Openeye Name: 4-(o-tolyl)-5-(p-tolyl)-1,2,4-triazole-3-thiolate CAS Name: 4-(2-methylphenyl)-5-(4-methylphenyl)-1,2,4-triazole-3-thiolate IUPAC Name: 4-(2-methylphenyl)-5-(4-methylphenyl)-1,2,4-triazole-3-thiolate Traditional Name: 4-(o-tolyl)-5-(p-tolyl)-1,2,4-triazole-3-thiolate Formula: C16H14N3S- MolecularWeight: 280.36746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3C)[S-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3C)[S-]

InChI

InChI=1S/C16H15N3S/c1-11-7-9-13(10-8-11)15-17-18-16(20)19(15)14-6-4-3-5-12(14)2/h3-10H,1-2H3,(H,18,20)/p-1