N-(6-methylsulfanyl-1-oxidanyl-hexyl)-2-(phenylmethyl)-3-sulfanyl-propanamide

Systemtic Name: N-(6-methylsulfanyl-1-oxidanyl-hexyl)-2-(phenylmethyl)-3-sulfanyl-propanamide Openeye Name: 2-benzyl-N-(1-hydroxy-6-methylsulfanyl-hexyl)-3-sulfanyl-propanamide CAS Name: N-[1-hydroxy-6-(methylthio)hexyl]-2-(mercaptomethyl)-3-phenylpropanamide IUPAC Name: 2-benzyl-N-(1-hydroxy-6-methylsulfanylhexyl)-3-sulfanylpropanamide Traditional Name: 2-benzyl-N-[1-hydroxy-6-(methylthio)hexyl]-3-mercapto-propionamide Formula: C17H27NO2S2 MolecularWeight: 341.53178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCCCCC(NC(=O)C(CC1=CC=CC=C1)CS)O

Isomeric SMILES

CSCCCCCC(NC(=O)C(CC1=CC=CC=C1)CS)O

InChI

InChI=1S/C17H27NO2S2/c1-22-11-7-3-6-10-16(19)18-17(20)15(13-21)12-14-8-4-2-5-9-14/h2,4-5,8-9,15-16,19,21H,3,6-7,10-13H2,1H3,(H,18,20)