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

Systemtic Name: [5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl] (1Z)-N-[(3-methylphenyl)amino]-2-oxidanylidene-propanimidothioate Openeye Name: [5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl] (1Z)-N-(3-methylanilino)-2-oxo-propanimidothioate CAS Name: (1Z)-N-(3-methylanilino)-2-oxopropanimidothioic acid [5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl] ester IUPAC Name: [5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl] (1Z)-N-(3-methylanilino)-2-oxopropanimidothioate Traditional Name: (1Z)-2-keto-N-(m-toluidino)thiopropionimidic acid [5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl] ester Formula: C20H21N5O2S MolecularWeight: 395.47804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NN=C(C(=O)C)SC2=NN=C(N2C)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC(=CC=C1)N/N=C(/C(=O)C)\SC2=NN=C(N2C)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H21N5O2S/c1-13-6-5-7-16(12-13)21-23-19(14(2)26)28-20-24-22-18(25(20)3)15-8-10-17(27-4)11-9-15/h5-12,21H,1-4H3/b23-19-