2-(3-cyano-6,7-dimethyl-quinolin-2-yl)sulfanyl-N-(3-fluorophenyl)ethanamide

Systemtic Name: 2-(3-cyano-6,7-dimethyl-quinolin-2-yl)sulfanyl-N-(3-fluorophenyl)ethanamide Openeye Name: 2-[(3-cyano-6,7-dimethyl-2-quinolyl)sulfanyl]-N-(3-fluorophenyl)acetamide CAS Name: 2-[(3-cyano-6,7-dimethyl-2-quinolinyl)thio]-N-(3-fluorophenyl)acetamide IUPAC Name: 2-(3-cyano-6,7-dimethylquinolin-2-yl)sulfanyl-N-(3-fluorophenyl)acetamide Traditional Name: 2-[(3-cyano-6,7-dimethyl-2-quinolyl)thio]-N-(3-fluorophenyl)acetamide Formula: C20H16FN3OS MolecularWeight: 365.423943

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H16FN3OS/c1-12-6-14-8-15(10-22)20(24-18(14)7-13(12)2)26-11-19(25)23-17-5-3-4-16(21)9-17/h3-9H,11H2,1-2H3,(H,23,25)