2-(3-cyano-6,8-dimethyl-quinolin-2-yl)sulfanyl-N-(4-dimethylaminophenyl)ethanamide

Systemtic Name: 2-(3-cyano-6,8-dimethyl-quinolin-2-yl)sulfanyl-N-(4-dimethylaminophenyl)ethanamide Openeye Name: 2-[(3-cyano-6,8-dimethyl-2-quinolyl)sulfanyl]-N-(4-dimethylaminophenyl)acetamide CAS Name: 2-[(3-cyano-6,8-dimethyl-2-quinolinyl)thio]-N-(4-dimethylaminophenyl)acetamide IUPAC Name: 2-(3-cyano-6,8-dimethylquinolin-2-yl)sulfanyl-N-(4-dimethylaminophenyl)acetamide Traditional Name: 2-[(3-cyano-6,8-dimethyl-2-quinolyl)thio]-N-(4-dimethylaminophenyl)acetamide Formula: C22H22N4OS MolecularWeight: 390.50128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C=C(C(=N2)SCC(=O)NC3=CC=C(C=C3)N(C)C)C#N)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C=C(C(=N2)SCC(=O)NC3=CC=C(C=C3)N(C)C)C#N)C

InChI

InChI=1S/C22H22N4OS/c1-14-9-15(2)21-16(10-14)11-17(12-23)22(25-21)28-13-20(27)24-18-5-7-19(8-6-18)26(3)4/h5-11H,13H2,1-4H3,(H,24,27)