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

Systemtic Name: 4-[(4-methylphenyl)carbamothioylamino]-5-phenyl-1,2,4-triazole-3-thiolate Openeye Name: 5-phenyl-4-(p-tolylcarbamothioylamino)-1,2,4-triazole-3-thiolate CAS Name: 4-[[(4-methylanilino)-sulfanylidenemethyl]amino]-5-phenyl-1,2,4-triazole-3-thiolate IUPAC Name: 4-[(4-methylphenyl)carbamothioylamino]-5-phenyl-1,2,4-triazole-3-thiolate Traditional Name: 5-phenyl-4-(p-tolylthiocarbamoylamino)-1,2,4-triazole-3-thiolate Formula: C16H14N5S2- MolecularWeight: 340.44586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)NN2C(=NN=C2[S-])C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)NN2C(=NN=C2[S-])C3=CC=CC=C3

InChI

InChI=1S/C16H15N5S2/c1-11-7-9-13(10-8-11)17-15(22)20-21-14(18-19-16(21)23)12-5-3-2-4-6-12/h2-10H,1H3,(H,19,23)(H2,17,20,22)/p-1