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

Systemtic Name: [5-(2,4-dichlorophenyl)-4-phenyl-1,2,4-triazol-3-yl] (1Z)-N-[(4-methylphenyl)amino]-2-oxidanylidene-propanimidothioate Openeye Name: [5-(2,4-dichlorophenyl)-4-phenyl-1,2,4-triazol-3-yl] (1Z)-N-(4-methylanilino)-2-oxo-propanimidothioate CAS Name: (1Z)-N-(4-methylanilino)-2-oxopropanimidothioic acid [5-(2,4-dichlorophenyl)-4-phenyl-1,2,4-triazol-3-yl] ester IUPAC Name: [5-(2,4-dichlorophenyl)-4-phenyl-1,2,4-triazol-3-yl] (1Z)-N-(4-methylanilino)-2-oxopropanimidothioate Traditional Name: (1Z)-2-keto-N-(p-toluidino)thiopropionimidic acid [5-(2,4-dichlorophenyl)-4-phenyl-1,2,4-triazol-3-yl] ester Formula: C24H19Cl2N5OS MolecularWeight: 496.41156

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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=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

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

InChI

InChI=1S/C24H19Cl2N5OS/c1-15-8-11-18(12-9-15)27-29-23(16(2)32)33-24-30-28-22(20-13-10-17(25)14-21(20)26)31(24)19-6-4-3-5-7-19/h3-14,27H,1-2H3/b29-23-