[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl] (1E)-2-oxidanylidene-N-phenylazanyl-propanimidothioate

Systemtic Name: [5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl] (1E)-2-oxidanylidene-N-phenylazanyl-propanimidothioate Openeye Name: [5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl] (1E)-N-anilino-2-oxo-propanimidothioate CAS Name: (1E)-N-anilino-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] (1E)-N-anilino-2-oxopropanimidothioate Traditional Name: (1E)-N-anilino-2-keto-thiopropionimidic acid [5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl] ester Formula: C19H19N5O2S MolecularWeight: 381.45146

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=NNC1=CC=CC=C1)SC2=NN=C(N2C)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(=O)/C(=N\NC1=CC=CC=C1)/SC2=NN=C(N2C)C3=CC=C(C=C3)OC

InChI

InChI=1S/C19H19N5O2S/c1-13(25)18(22-20-15-7-5-4-6-8-15)27-19-23-21-17(24(19)2)14-9-11-16(26-3)12-10-14/h4-12,20H,1-3H3/b22-18+