2-(3-cyano-6-ethoxy-quinolin-2-yl)sulfanyl-N-(2-ethylphenyl)ethanamide

Systemtic Name: 2-(3-cyano-6-ethoxy-quinolin-2-yl)sulfanyl-N-(2-ethylphenyl)ethanamide Openeye Name: 2-[(3-cyano-6-ethoxy-2-quinolyl)sulfanyl]-N-(2-ethylphenyl)acetamide CAS Name: 2-[(3-cyano-6-ethoxy-2-quinolinyl)thio]-N-(2-ethylphenyl)acetamide IUPAC Name: 2-(3-cyano-6-ethoxyquinolin-2-yl)sulfanyl-N-(2-ethylphenyl)acetamide Traditional Name: 2-[(3-cyano-6-ethoxy-2-quinolyl)thio]-N-(2-ethylphenyl)acetamide Formula: C22H21N3O2S MolecularWeight: 391.48604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CSC2=NC3=C(C=C(C=C3)OCC)C=C2C#N

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CSC2=NC3=C(C=C(C=C3)OCC)C=C2C#N

InChI

InChI=1S/C22H21N3O2S/c1-3-15-7-5-6-8-19(15)24-21(26)14-28-22-17(13-23)11-16-12-18(27-4-2)9-10-20(16)25-22/h5-12H,3-4,14H2,1-2H3,(H,24,26)