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

Systemtic Name: cyclohexyl (1E)-2-oxidanylidene-N-phenylazanyl-2-[[3-(trifluoromethyl)phenyl]amino]ethanimidothioate Openeye Name: cyclohexyl (1E)-N-anilino-2-oxo-2-[3-(trifluoromethyl)anilino]ethanimidothioate CAS Name: (1E)-N-anilino-2-oxo-2-[3-(trifluoromethyl)anilino]ethanimidothioic acid cyclohexyl ester IUPAC Name: cyclohexyl (1E)-N-anilino-2-oxo-2-[3-(trifluoromethyl)anilino]ethanimidothioate Traditional Name: (1E)-N-anilino-2-keto-2-[3-(trifluoromethyl)anilino]thioacetimidic acid cyclohexyl ester Formula: C21H22F3N3OS MolecularWeight: 421.47909

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)SC(=NNC2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1CCC(CC1)S/C(=N/NC2=CC=CC=C2)/C(=O)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C21H22F3N3OS/c22-21(23,24)15-8-7-11-17(14-15)25-19(28)20(29-18-12-5-2-6-13-18)27-26-16-9-3-1-4-10-16/h1,3-4,7-11,14,18,26H,2,5-6,12-13H2,(H,25,28)/b27-20+