N-(3,5-dimethoxyphenyl)-2-(phenylmethylsulfanyl)propanamide

Systemtic Name: N-(3,5-dimethoxyphenyl)-2-(phenylmethylsulfanyl)propanamide Openeye Name: 2-benzylsulfanyl-N-(3,5-dimethoxyphenyl)propanamide CAS Name: N-(3,5-dimethoxyphenyl)-2-(phenylmethylthio)propanamide IUPAC Name: 2-benzylsulfanyl-N-(3,5-dimethoxyphenyl)propanamide Traditional Name: 2-(benzylthio)-N-(3,5-dimethoxyphenyl)propionamide Formula: C18H21NO3S MolecularWeight: 331.42924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC(=C1)OC)OC)SCC2=CC=CC=C2

Isomeric SMILES

CC(C(=O)NC1=CC(=CC(=C1)OC)OC)SCC2=CC=CC=C2

InChI

InChI=1S/C18H21NO3S/c1-13(23-12-14-7-5-4-6-8-14)18(20)19-15-9-16(21-2)11-17(10-15)22-3/h4-11,13H,12H2,1-3H3,(H,19,20)