N-[2-(phenylmethylsulfanyl)ethyl]-1-pyrazin-2-yl-piperidine-3-carboxamide

Systemtic Name: N-[2-(phenylmethylsulfanyl)ethyl]-1-pyrazin-2-yl-piperidine-3-carboxamide Openeye Name: N-(2-benzylsulfanylethyl)-1-pyrazin-2-yl-piperidine-3-carboxamide CAS Name: N-[2-(phenylmethylthio)ethyl]-1-(2-pyrazinyl)-3-piperidinecarboxamide IUPAC Name: N-(2-benzylsulfanylethyl)-1-pyrazin-2-ylpiperidine-3-carboxamide Traditional Name: N-[2-(benzylthio)ethyl]-1-pyrazin-2-yl-nipecotamide Formula: C19H24N4OS MolecularWeight: 356.48506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC=CN=C2)C(=O)NCCSCC3=CC=CC=C3

Isomeric SMILES

C1CC(CN(C1)C2=NC=CN=C2)C(=O)NCCSCC3=CC=CC=C3

InChI

InChI=1S/C19H24N4OS/c24-19(22-10-12-25-15-16-5-2-1-3-6-16)17-7-4-11-23(14-17)18-13-20-8-9-21-18/h1-3,5-6,8-9,13,17H,4,7,10-12,14-15H2,(H,22,24)