N-[2-(phenylmethylsulfanyl)ethyl]-1-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide

Systemtic Name: N-[2-(phenylmethylsulfanyl)ethyl]-1-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide Openeye Name: N-(2-benzylsulfanylethyl)-1-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]piperidine-3-carboxamide CAS Name: N-[2-(phenylmethylthio)ethyl]-1-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]-3-piperidinecarboxamide IUPAC Name: N-(2-benzylsulfanylethyl)-1-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide Traditional Name: N-[2-(benzylthio)ethyl]-1-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]nipecotamide Formula: C22H26N4O2S2 MolecularWeight: 442.59744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=NC(=NO2)C3=CC=CS3)C(=O)NCCSCC4=CC=CC=C4

Isomeric SMILES

C1CC(CN(C1)CC2=NC(=NO2)C3=CC=CS3)C(=O)NCCSCC4=CC=CC=C4

InChI

InChI=1S/C22H26N4O2S2/c27-22(23-10-13-29-16-17-6-2-1-3-7-17)18-8-4-11-26(14-18)15-20-24-21(25-28-20)19-9-5-12-30-19/h1-3,5-7,9,12,18H,4,8,10-11,13-16H2,(H,23,27)