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

Systemtic Name: 2-(3-cyano-8-methyl-quinolin-2-yl)sulfanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]ethanamide Openeye Name: 2-[(3-cyano-8-methyl-2-quinolyl)sulfanyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide CAS Name: 2-[(3-cyano-8-methyl-2-quinolinyl)thio]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide IUPAC Name: 2-(3-cyano-8-methylquinolin-2-yl)sulfanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide Traditional Name: 2-[(3-cyano-8-methyl-2-quinolyl)thio]-N-homoveratryl-acetamide Formula: C23H23N3O3S MolecularWeight: 421.51202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C(=C2)C#N)SCC(=O)NCCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC=CC2=C1N=C(C(=C2)C#N)SCC(=O)NCCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C23H23N3O3S/c1-15-5-4-6-17-12-18(13-24)23(26-22(15)17)30-14-21(27)25-10-9-16-7-8-19(28-2)20(11-16)29-3/h4-8,11-12H,9-10,14H2,1-3H3,(H,25,27)