3-(3-methylphenyl)-4-phenyl-2H-1,2,3-triazole-1-carbothioamide

Systemtic Name: 3-(3-methylphenyl)-4-phenyl-2H-1,2,3-triazole-1-carbothioamide Openeye Name: 3-(m-tolyl)-4-phenyl-2H-triazole-1-carbothioamide CAS Name: 3-(3-methylphenyl)-4-phenyl-2H-triazole-1-carbothioamide IUPAC Name: 3-(3-methylphenyl)-4-phenyl-2H-triazole-1-carbothioamide Traditional Name: 3-(m-tolyl)-4-phenyl-2H-triazole-1-carbothioamide Formula: C16H16N4S MolecularWeight: 296.39004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=CN(N2)C(=S)N)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=CN(N2)C(=S)N)C3=CC=CC=C3

InChI

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