N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-ethyl-7,8-dimethyl-quinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-ethyl-7,8-dimethyl-quinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(3-ethyl-7,8-dimethyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(3-ethyl-7,8-dimethyl-2-quinolinyl)thio]acetamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-ethyl-7,8-dimethylquinolin-2-yl)sulfanylacetamide Traditional Name: 2-[(3-ethyl-7,8-dimethyl-2-quinolyl)thio]-N-homoveratryl-acetamide Formula: C25H30N2O3S MolecularWeight: 438.5823

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C2C(=C(C=CC2=C1)C)C)SCC(=O)NCCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCC1=C(N=C2C(=C(C=CC2=C1)C)C)SCC(=O)NCCC3=CC(=C(C=C3)OC)OC

InChI

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