ethyl 1-[2-(thiophen-2-ylmethylsulfanyl)ethanoyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[2-(thiophen-2-ylmethylsulfanyl)ethanoyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[2-(2-thienylmethylsulfanyl)acetyl]piperidine-3-carboxylate CAS Name: 1-[1-oxo-2-(thiophen-2-ylmethylthio)ethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(thiophen-2-ylmethylsulfanyl)acetyl]piperidine-3-carboxylate Traditional Name: 1-[2-(2-thenylthio)acetyl]nipecotic acid ethyl ester Formula: C15H21NO3S2 MolecularWeight: 327.46214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)CSCC2=CC=CS2

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)CSCC2=CC=CS2

InChI

InChI=1S/C15H21NO3S2/c1-2-19-15(18)12-5-3-7-16(9-12)14(17)11-20-10-13-6-4-8-21-13/h4,6,8,12H,2-3,5,7,9-11H2,1H3