(4-methylphenyl) (1E)-2-oxidanylidene-N-phenylazanyl-2-[[3-(trifluoromethyl)phenyl]amino]ethanimidothioate

Systemtic Name: (4-methylphenyl) (1E)-2-oxidanylidene-N-phenylazanyl-2-[[3-(trifluoromethyl)phenyl]amino]ethanimidothioate Openeye Name: p-tolyl (1E)-N-anilino-2-oxo-2-[3-(trifluoromethyl)anilino]ethanimidothioate CAS Name: (1E)-N-anilino-2-oxo-2-[3-(trifluoromethyl)anilino]ethanimidothioic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) (1E)-N-anilino-2-oxo-2-[3-(trifluoromethyl)anilino]ethanimidothioate Traditional Name: (1E)-N-anilino-2-keto-2-[3-(trifluoromethyl)anilino]thioacetimidic acid p-tolyl ester Formula: C22H18F3N3OS MolecularWeight: 429.45803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(=NNC2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)S/C(=N/NC2=CC=CC=C2)/C(=O)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C22H18F3N3OS/c1-15-10-12-19(13-11-15)30-21(28-27-17-7-3-2-4-8-17)20(29)26-18-9-5-6-16(14-18)22(23,24)25/h2-14,27H,1H3,(H,26,29)/b28-21+