(4,5-diphenyl-1,2,4-triazol-3-yl) (1Z)-N-[(4-methylphenyl)amino]-2-oxidanylidene-propanimidothioate

Systemtic Name: (4,5-diphenyl-1,2,4-triazol-3-yl) (1Z)-N-[(4-methylphenyl)amino]-2-oxidanylidene-propanimidothioate Openeye Name: (4,5-diphenyl-1,2,4-triazol-3-yl) (1Z)-N-(4-methylanilino)-2-oxo-propanimidothioate CAS Name: (1Z)-N-(4-methylanilino)-2-oxopropanimidothioic acid (4,5-diphenyl-1,2,4-triazol-3-yl) ester IUPAC Name: (4,5-diphenyl-1,2,4-triazol-3-yl) (1Z)-N-(4-methylanilino)-2-oxopropanimidothioate Traditional Name: (1Z)-2-keto-N-(p-toluidino)thiopropionimidic acid (4,5-diphenyl-1,2,4-triazol-3-yl) ester Formula: C24H21N5OS MolecularWeight: 427.52144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NN=C(C(=O)C)SC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)N/N=C(/C(=O)C)\SC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H21N5OS/c1-17-13-15-20(16-14-17)25-27-23(18(2)30)31-24-28-26-22(19-9-5-3-6-10-19)29(24)21-11-7-4-8-12-21/h3-16,25H,1-2H3/b27-23-