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

Systemtic Name: ethyl 1-[(4-fluorophenyl)carbamothioyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[(4-fluorophenyl)carbamothioyl]piperidine-4-carboxylate CAS Name: 1-[(4-fluoroanilino)-sulfanylidenemethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(4-fluorophenyl)carbamothioyl]piperidine-4-carboxylate Traditional Name: 1-[(4-fluorophenyl)thiocarbamoyl]isonipecotic acid ethyl ester Formula: C15H19FN2O2S MolecularWeight: 310.386963

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=S)NC2=CC=C(C=C2)F

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=S)NC2=CC=C(C=C2)F

InChI

InChI=1S/C15H19FN2O2S/c1-2-20-14(19)11-7-9-18(10-8-11)15(21)17-13-5-3-12(16)4-6-13/h3-6,11H,2,7-10H2,1H3,(H,17,21)