3-[[(4-methylphenyl)amino]methyl]-4-phenyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[[(4-methylphenyl)amino]methyl]-4-phenyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(4-methylanilino)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione CAS Name: 3-[(4-methylanilino)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(4-methylanilino)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-phenyl-3-(p-toluidinomethyl)-1H-1,2,4-triazole-5-thione Formula: C16H16N4S MolecularWeight: 296.39004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NCC2=NNC(=S)N2C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)NCC2=NNC(=S)N2C3=CC=CC=C3

InChI

InChI=1S/C16H16N4S/c1-12-7-9-13(10-8-12)17-11-15-18-19-16(21)20(15)14-5-3-2-4-6-14/h2-10,17H,11H2,1H3,(H,19,21)