N-[2-(2,3-dimethoxyphenyl)-2-(1H-indol-3-yl)ethyl]-3-methylsulfanyl-propanamide

Systemtic Name: N-[2-(2,3-dimethoxyphenyl)-2-(1H-indol-3-yl)ethyl]-3-methylsulfanyl-propanamide Openeye Name: N-[2-(2,3-dimethoxyphenyl)-2-(1H-indol-3-yl)ethyl]-3-methylsulfanyl-propanamide CAS Name: N-[2-(2,3-dimethoxyphenyl)-2-(1H-indol-3-yl)ethyl]-3-(methylthio)propanamide IUPAC Name: N-[2-(2,3-dimethoxyphenyl)-2-(1H-indol-3-yl)ethyl]-3-methylsulfanylpropanamide Traditional Name: N-[2-(2,3-dimethoxyphenyl)-2-(1H-indol-3-yl)ethyl]-3-(methylthio)propionamide Formula: C22H26N2O3S MolecularWeight: 398.51844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C(CNC(=O)CCSC)C2=CNC3=CC=CC=C32

Isomeric SMILES

COC1=CC=CC(=C1OC)C(CNC(=O)CCSC)C2=CNC3=CC=CC=C32

InChI

InChI=1S/C22H26N2O3S/c1-26-20-10-6-8-16(22(20)27-2)18(14-24-21(25)11-12-28-3)17-13-23-19-9-5-4-7-15(17)19/h4-10,13,18,23H,11-12,14H2,1-3H3,(H,24,25)