2-(3-cyano-6-methyl-quinolin-2-yl)sulfanyl-N-(4-fluorophenyl)ethanamide

Systemtic Name: 2-(3-cyano-6-methyl-quinolin-2-yl)sulfanyl-N-(4-fluorophenyl)ethanamide Openeye Name: 2-[(3-cyano-6-methyl-2-quinolyl)sulfanyl]-N-(4-fluorophenyl)acetamide CAS Name: 2-[(3-cyano-6-methyl-2-quinolinyl)thio]-N-(4-fluorophenyl)acetamide IUPAC Name: 2-(3-cyano-6-methylquinolin-2-yl)sulfanyl-N-(4-fluorophenyl)acetamide Traditional Name: 2-[(3-cyano-6-methyl-2-quinolyl)thio]-N-(4-fluorophenyl)acetamide Formula: C19H14FN3OS MolecularWeight: 351.397363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C19H14FN3OS/c1-12-2-7-17-13(8-12)9-14(10-21)19(23-17)25-11-18(24)22-16-5-3-15(20)4-6-16/h2-9H,11H2,1H3,(H,22,24)