2-(3-cyano-6-ethoxy-quinolin-2-yl)sulfanyl-N-(2,5-dimethylphenyl)ethanamide

Systemtic Name: 2-(3-cyano-6-ethoxy-quinolin-2-yl)sulfanyl-N-(2,5-dimethylphenyl)ethanamide Openeye Name: 2-[(3-cyano-6-ethoxy-2-quinolyl)sulfanyl]-N-(2,5-dimethylphenyl)acetamide CAS Name: 2-[(3-cyano-6-ethoxy-2-quinolinyl)thio]-N-(2,5-dimethylphenyl)acetamide IUPAC Name: 2-(3-cyano-6-ethoxyquinolin-2-yl)sulfanyl-N-(2,5-dimethylphenyl)acetamide Traditional Name: 2-[(3-cyano-6-ethoxy-2-quinolyl)thio]-N-(2,5-dimethylphenyl)acetamide Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)NC3=C(C=CC(=C3)C)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)NC3=C(C=CC(=C3)C)C

InChI

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