N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(1-methyl-2-oxidanylidene-quinolin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(1-methyl-2-oxidanylidene-quinolin-4-yl)sulfanyl-ethanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(1-methyl-2-oxo-4-quinolyl)sulfanyl]acetamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(1-methyl-2-oxo-4-quinolinyl)thio]acetamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(1-methyl-2-oxoquinolin-4-yl)sulfanylacetamide Traditional Name: N-homoveratryl-2-[(2-keto-1-methyl-4-quinolyl)thio]acetamide Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=CC1=O)SCC(=O)NCCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CN1C2=CC=CC=C2C(=CC1=O)SCC(=O)NCCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H24N2O4S/c1-24-17-7-5-4-6-16(17)20(13-22(24)26)29-14-21(25)23-11-10-15-8-9-18(27-2)19(12-15)28-3/h4-9,12-13H,10-11,14H2,1-3H3,(H,23,25)