[2-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]amino]ethyl] N-phenylpiperidine-1-carboximidothioate

Systemtic Name: [2-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]amino]ethyl] N-phenylpiperidine-1-carboximidothioate Openeye Name: [2-oxo-2-[3-(trifluoromethyl)anilino]ethyl] N-phenylpiperidine-1-carboximidothioate CAS Name: N-phenyl-1-piperidinecarboximidothioic acid [2-oxo-2-[3-(trifluoromethyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-[3-(trifluoromethyl)anilino]ethyl] N-phenylpiperidine-1-carboximidothioate Traditional Name: N-phenylpiperidine-1-carboximidothioic acid [2-keto-2-[3-(trifluoromethyl)anilino]ethyl] ester Formula: C21H22F3N3OS MolecularWeight: 421.47909

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=NC2=CC=CC=C2)SCC(=O)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1CCN(CC1)C(=NC2=CC=CC=C2)SCC(=O)NC3=CC=CC(=C3)C(F)(F)F

InChI

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