1-(furan-3-ylcarbonyl)-N-[2-(4-methylphenyl)sulfanylethyl]piperidine-3-carboxamide

Systemtic Name: 1-(furan-3-ylcarbonyl)-N-[2-(4-methylphenyl)sulfanylethyl]piperidine-3-carboxamide Openeye Name: 1-(furan-3-carbonyl)-N-[2-(p-tolylsulfanyl)ethyl]piperidine-3-carboxamide CAS Name: 1-[3-furanyl(oxo)methyl]-N-[2-[(4-methylphenyl)thio]ethyl]-3-piperidinecarboxamide IUPAC Name: 1-(furan-3-carbonyl)-N-[2-(4-methylphenyl)sulfanylethyl]piperidine-3-carboxamide Traditional Name: 1-(3-furoyl)-N-[2-(p-tolylthio)ethyl]nipecotamide Formula: C20H24N2O3S MolecularWeight: 372.48116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)C2CCCN(C2)C(=O)C3=COC=C3

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)C2CCCN(C2)C(=O)C3=COC=C3

InChI

InChI=1S/C20H24N2O3S/c1-15-4-6-18(7-5-15)26-12-9-21-19(23)16-3-2-10-22(13-16)20(24)17-8-11-25-14-17/h4-8,11,14,16H,2-3,9-10,12-13H2,1H3,(H,21,23)