ethyl 1-(2-pyridin-4-ylsulfanylethanoyl)piperidine-3-carboxylate

Systemtic Name: ethyl 1-(2-pyridin-4-ylsulfanylethanoyl)piperidine-3-carboxylate Openeye Name: ethyl 1-[2-(4-pyridylsulfanyl)acetyl]piperidine-3-carboxylate CAS Name: 1-[1-oxo-2-(pyridin-4-ylthio)ethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-pyridin-4-ylsulfanylacetyl)piperidine-3-carboxylate Traditional Name: 1-[2-(4-pyridylthio)acetyl]nipecotic acid ethyl ester Formula: C15H20N2O3S MolecularWeight: 308.3959

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)CSC2=CC=NC=C2

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)CSC2=CC=NC=C2

InChI

InChI=1S/C15H20N2O3S/c1-2-20-15(19)12-4-3-9-17(10-12)14(18)11-21-13-5-7-16-8-6-13/h5-8,12H,2-4,9-11H2,1H3