ethyl 1-[(4-fluorophenyl)carbonylcarbamothioyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(4-fluorophenyl)carbonylcarbamothioyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[(4-fluorobenzoyl)carbamothioyl]piperidine-4-carboxylate CAS Name: 1-[[[(4-fluorophenyl)-oxomethyl]amino]-sulfanylidenemethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(4-fluorobenzoyl)carbamothioyl]piperidine-4-carboxylate Traditional Name: 1-[(4-fluorobenzoyl)thiocarbamoyl]isonipecotic acid ethyl ester Formula: C16H19FN2O3S MolecularWeight: 338.397063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=S)NC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=S)NC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C16H19FN2O3S/c1-2-22-15(21)12-7-9-19(10-8-12)16(23)18-14(20)11-3-5-13(17)6-4-11/h3-6,12H,2,7-10H2,1H3,(H,18,20,23)