2-(3-cyano-6-ethoxy-quinolin-2-yl)sulfanyl-N-(4-dimethylaminophenyl)ethanamide

Systemtic Name: 2-(3-cyano-6-ethoxy-quinolin-2-yl)sulfanyl-N-(4-dimethylaminophenyl)ethanamide Openeye Name: 2-[(3-cyano-6-ethoxy-2-quinolyl)sulfanyl]-N-(4-dimethylaminophenyl)acetamide CAS Name: 2-[(3-cyano-6-ethoxy-2-quinolinyl)thio]-N-(4-dimethylaminophenyl)acetamide IUPAC Name: 2-(3-cyano-6-ethoxyquinolin-2-yl)sulfanyl-N-(4-dimethylaminophenyl)acetamide Traditional Name: 2-[(3-cyano-6-ethoxy-2-quinolyl)thio]-N-(4-dimethylaminophenyl)acetamide Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22N4O2S/c1-4-28-19-9-10-20-15(12-19)11-16(13-23)22(25-20)29-14-21(27)24-17-5-7-18(8-6-17)26(2)3/h5-12H,4,14H2,1-3H3,(H,24,27)