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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)NC3=CC=C(C=C3)N(C)C

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)NC3=CC=C(C=C3)N(C)C

InChI

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