N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-ethyl-6,7-dimethyl-quinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-ethyl-6,7-dimethyl-quinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(3-ethyl-6,7-dimethyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(3-ethyl-6,7-dimethyl-2-quinolinyl)thio]acetamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-ethyl-6,7-dimethylquinolin-2-yl)sulfanylacetamide Traditional Name: 2-[(3-ethyl-6,7-dimethyl-2-quinolyl)thio]-N-homoveratryl-acetamide Formula: C25H30N2O3S MolecularWeight: 438.5823

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=CC(=C(C=C2N=C1SCC(=O)NCCC3=CC(=C(C=C3)OC)OC)C)C

Isomeric SMILES

CCC1=CC2=CC(=C(C=C2N=C1SCC(=O)NCCC3=CC(=C(C=C3)OC)OC)C)C

InChI

InChI=1S/C25H30N2O3S/c1-6-19-14-20-11-16(2)17(3)12-21(20)27-25(19)31-15-24(28)26-10-9-18-7-8-22(29-4)23(13-18)30-5/h7-8,11-14H,6,9-10,15H2,1-5H3,(H,26,28)