1-[(3-ethoxyphenyl)methyl]-N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]piperidine-4-carboxamide

Systemtic Name: 1-[(3-ethoxyphenyl)methyl]-N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]piperidine-4-carboxamide Openeye Name: 1-[(3-ethoxyphenyl)methyl]-N-[2-(p-tolylmethylsulfanyl)ethyl]piperidine-4-carboxamide CAS Name: 1-[(3-ethoxyphenyl)methyl]-N-[2-[(4-methylphenyl)methylthio]ethyl]-4-piperidinecarboxamide IUPAC Name: 1-[(3-ethoxyphenyl)methyl]-N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]piperidine-4-carboxamide Traditional Name: 1-(3-ethoxybenzyl)-N-[2-[(4-methylbenzyl)thio]ethyl]isonipecotamide Formula: C25H34N2O2S MolecularWeight: 426.61466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)CN2CCC(CC2)C(=O)NCCSCC3=CC=C(C=C3)C

Isomeric SMILES

CCOC1=CC=CC(=C1)CN2CCC(CC2)C(=O)NCCSCC3=CC=C(C=C3)C

InChI

InChI=1S/C25H34N2O2S/c1-3-29-24-6-4-5-22(17-24)18-27-14-11-23(12-15-27)25(28)26-13-16-30-19-21-9-7-20(2)8-10-21/h4-10,17,23H,3,11-16,18-19H2,1-2H3,(H,26,28)