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

Systemtic Name: ethyl 1-[(phenylmethyl)carbamothioyl]piperidine-4-carboxylate Openeye Name: ethyl 1-(benzylcarbamothioyl)piperidine-4-carboxylate CAS Name: 1-[[(phenylmethyl)amino]-sulfanylidenemethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(benzylcarbamothioyl)piperidine-4-carboxylate Traditional Name: 1-(benzylthiocarbamoyl)isonipecotic acid ethyl ester Formula: C16H22N2O2S MolecularWeight: 306.42308

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=S)NCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=S)NCC2=CC=CC=C2

InChI

InChI=1S/C16H22N2O2S/c1-2-20-15(19)14-8-10-18(11-9-14)16(21)17-12-13-6-4-3-5-7-13/h3-7,14H,2,8-12H2,1H3,(H,17,21)