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

Systemtic Name: 5-(4-methylphenyl)-4-[(4-methylphenyl)carbamothioylamino]-1,2,4-triazole-3-thiolate Openeye Name: 5-(p-tolyl)-4-(p-tolylcarbamothioylamino)-1,2,4-triazole-3-thiolate CAS Name: 4-[[(4-methylanilino)-sulfanylidenemethyl]amino]-5-(4-methylphenyl)-1,2,4-triazole-3-thiolate IUPAC Name: 5-(4-methylphenyl)-4-[(4-methylphenyl)carbamothioylamino]-1,2,4-triazole-3-thiolate Traditional Name: 5-(p-tolyl)-4-(p-tolylthiocarbamoylamino)-1,2,4-triazole-3-thiolate Formula: C17H16N5S2- MolecularWeight: 354.47244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(N2NC(=S)NC3=CC=C(C=C3)C)[S-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(N2NC(=S)NC3=CC=C(C=C3)C)[S-]

InChI

InChI=1S/C17H17N5S2/c1-11-3-7-13(8-4-11)15-19-20-17(24)22(15)21-16(23)18-14-9-5-12(2)6-10-14/h3-10H,1-2H3,(H,20,24)(H2,18,21,23)/p-1