3-(4,8-dimethylquinolin-2-yl)sulfanyl-N-[2-(trifluoromethyl)phenyl]propanamide

Systemtic Name: 3-(4,8-dimethylquinolin-2-yl)sulfanyl-N-[2-(trifluoromethyl)phenyl]propanamide Openeye Name: 3-[(4,8-dimethyl-2-quinolyl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]propanamide CAS Name: 3-[(4,8-dimethyl-2-quinolinyl)thio]-N-[2-(trifluoromethyl)phenyl]propanamide IUPAC Name: 3-(4,8-dimethylquinolin-2-yl)sulfanyl-N-[2-(trifluoromethyl)phenyl]propanamide Traditional Name: 3-[(4,8-dimethyl-2-quinolyl)thio]-N-[2-(trifluoromethyl)phenyl]propionamide Formula: C21H19F3N2OS MolecularWeight: 404.44857

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)SCCC(=O)NC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)SCCC(=O)NC3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C21H19F3N2OS/c1-13-6-5-7-15-14(2)12-19(26-20(13)15)28-11-10-18(27)25-17-9-4-3-8-16(17)21(22,23)24/h3-9,12H,10-11H2,1-2H3,(H,25,27)