2-(3-cyano-7-methyl-quinolin-2-yl)sulfanyl-N-(2-ethyl-6-methyl-phenyl)ethanamide

Systemtic Name: 2-(3-cyano-7-methyl-quinolin-2-yl)sulfanyl-N-(2-ethyl-6-methyl-phenyl)ethanamide Openeye Name: 2-[(3-cyano-7-methyl-2-quinolyl)sulfanyl]-N-(2-ethyl-6-methyl-phenyl)acetamide CAS Name: 2-[(3-cyano-7-methyl-2-quinolinyl)thio]-N-(2-ethyl-6-methylphenyl)acetamide IUPAC Name: 2-(3-cyano-7-methylquinolin-2-yl)sulfanyl-N-(2-ethyl-6-methylphenyl)acetamide Traditional Name: 2-[(3-cyano-7-methyl-2-quinolyl)thio]-N-(2-ethyl-6-methyl-phenyl)acetamide Formula: C22H21N3OS MolecularWeight: 375.48664

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21N3OS/c1-4-16-7-5-6-15(3)21(16)25-20(26)13-27-22-18(12-23)11-17-9-8-14(2)10-19(17)24-22/h5-11H,4,13H2,1-3H3,(H,25,26)