ethyl 1-[2-(4-chlorophenyl)ethylcarbamothioyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[2-(4-chlorophenyl)ethylcarbamothioyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[2-(4-chlorophenyl)ethylcarbamothioyl]piperidine-3-carboxylate CAS Name: 1-[[2-(4-chlorophenyl)ethylamino]-sulfanylidenemethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(4-chlorophenyl)ethylcarbamothioyl]piperidine-3-carboxylate Traditional Name: 1-[2-(4-chlorophenyl)ethylthiocarbamoyl]nipecotic acid ethyl ester Formula: C17H23ClN2O2S MolecularWeight: 354.89472

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=S)NCCC2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=S)NCCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H23ClN2O2S/c1-2-22-16(21)14-4-3-11-20(12-14)17(23)19-10-9-13-5-7-15(18)8-6-13/h5-8,14H,2-4,9-12H2,1H3,(H,19,23)