N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4,6,8-trimethylquinolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4,6,8-trimethylquinolin-2-yl)sulfanyl-propanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(4,6,8-trimethyl-2-quinolyl)sulfanyl]propanamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(4,6,8-trimethyl-2-quinolinyl)thio]propanamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4,6,8-trimethylquinolin-2-yl)sulfanylpropanamide Traditional Name: N-homoveratryl-2-[(4,6,8-trimethyl-2-quinolyl)thio]propionamide Formula: C25H30N2O3S MolecularWeight: 438.5823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)SC(C)C(=O)NCCC3=CC(=C(C=C3)OC)OC)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)SC(C)C(=O)NCCC3=CC(=C(C=C3)OC)OC)C)C

InChI

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