[2-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]amino]ethyl] N-phenylmorpholine-4-carboximidothioate

Systemtic Name: [2-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]amino]ethyl] N-phenylmorpholine-4-carboximidothioate Openeye Name: [2-oxo-2-[3-(trifluoromethyl)anilino]ethyl] N-phenylmorpholine-4-carboximidothioate CAS Name: N-phenyl-4-morpholinecarboximidothioic acid [2-oxo-2-[3-(trifluoromethyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-[3-(trifluoromethyl)anilino]ethyl] N-phenylmorpholine-4-carboximidothioate Traditional Name: N-phenylmorpholine-4-carboximidothioic acid [2-keto-2-[3-(trifluoromethyl)anilino]ethyl] ester Formula: C20H20F3N3O2S MolecularWeight: 423.45191

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=NC2=CC=CC=C2)SCC(=O)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1COCCN1C(=NC2=CC=CC=C2)SCC(=O)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C20H20F3N3O2S/c21-20(22,23)15-5-4-8-17(13-15)24-18(27)14-29-19(26-9-11-28-12-10-26)25-16-6-2-1-3-7-16/h1-8,13H,9-12,14H2,(H,24,27)