ethyl 1-[[4-(trifluoromethyl)phenyl]carbamothioyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[[4-(trifluoromethyl)phenyl]carbamothioyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[[4-(trifluoromethyl)phenyl]carbamothioyl]piperidine-3-carboxylate CAS Name: 1-[sulfanylidene-[4-(trifluoromethyl)anilino]methyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[4-(trifluoromethyl)phenyl]carbamothioyl]piperidine-3-carboxylate Traditional Name: 1-[[4-(trifluoromethyl)phenyl]thiocarbamoyl]nipecotic acid ethyl ester Formula: C16H19F3N2O2S MolecularWeight: 360.39447

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=S)NC2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=S)NC2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C16H19F3N2O2S/c1-2-23-14(22)11-4-3-9-21(10-11)15(24)20-13-7-5-12(6-8-13)16(17,18)19/h5-8,11H,2-4,9-10H2,1H3,(H,20,24)