S-methyl 2-(4-methylphenyl)-5-phenyl-1,2,3-triazole-4-carbothioate

Systemtic Name: S-methyl 2-(4-methylphenyl)-5-phenyl-1,2,3-triazole-4-carbothioate Openeye Name: S-methyl 5-phenyl-2-(p-tolyl)triazole-4-carbothioate CAS Name: 2-(4-methylphenyl)-5-phenyl-4-triazolecarbothioic acid S-methyl ester IUPAC Name: S-methyl 2-(4-methylphenyl)-5-phenyltriazole-4-carbothioate Traditional Name: 5-phenyl-2-(p-tolyl)triazole-4-carbothioic acid S-methyl ester Formula: C17H15N3OS MolecularWeight: 309.3855

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2N=C(C(=N2)C(=O)SC)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)N2N=C(C(=N2)C(=O)SC)C3=CC=CC=C3

InChI

InChI=1S/C17H15N3OS/c1-12-8-10-14(11-9-12)20-18-15(13-6-4-3-5-7-13)16(19-20)17(21)22-2/h3-11H,1-2H3