N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(oxolan-2-ylmethylsulfanyl)benzamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(oxolan-2-ylmethylsulfanyl)benzamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(tetrahydrofuran-2-ylmethylsulfanyl)benzamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(2-oxolanylmethylthio)benzamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(oxolan-2-ylmethylsulfanyl)benzamide Traditional Name: N-homoveratryl-2-(tetrahydrofurfurylthio)benzamide Formula: C22H27NO4S MolecularWeight: 401.51908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=CC=CC=C2SCC3CCCO3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=CC=CC=C2SCC3CCCO3)OC

InChI

InChI=1S/C22H27NO4S/c1-25-19-10-9-16(14-20(19)26-2)11-12-23-22(24)18-7-3-4-8-21(18)28-15-17-6-5-13-27-17/h3-4,7-10,14,17H,5-6,11-13,15H2,1-2H3,(H,23,24)