N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-2-quinolin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-2-quinolin-2-ylsulfanyl-ethanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-2-(2-quinolylsulfanyl)acetamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-2-(2-quinolinylthio)acetamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-2-quinolin-2-ylsulfanylacetamide Traditional Name: N-homoveratryl-N-methyl-2-(2-quinolylthio)acetamide Formula: C22H24N2O3S MolecularWeight: 396.50256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC(=C(C=C1)OC)OC)C(=O)CSC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CN(CCC1=CC(=C(C=C1)OC)OC)C(=O)CSC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C22H24N2O3S/c1-24(13-12-16-8-10-19(26-2)20(14-16)27-3)22(25)15-28-21-11-9-17-6-4-5-7-18(17)23-21/h4-11,14H,12-13,15H2,1-3H3