N-[5-chloranyl-2-(trifluoromethyl)phenyl]-3-(4-methylquinolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-[5-chloranyl-2-(trifluoromethyl)phenyl]-3-(4-methylquinolin-2-yl)sulfanyl-propanamide Openeye Name: N-[5-chloro-2-(trifluoromethyl)phenyl]-3-[(4-methyl-2-quinolyl)sulfanyl]propanamide CAS Name: N-[5-chloro-2-(trifluoromethyl)phenyl]-3-[(4-methyl-2-quinolinyl)thio]propanamide IUPAC Name: N-[5-chloro-2-(trifluoromethyl)phenyl]-3-(4-methylquinolin-2-yl)sulfanylpropanamide Traditional Name: N-[5-chloro-2-(trifluoromethyl)phenyl]-3-[(4-methyl-2-quinolyl)thio]propionamide Formula: C20H16ClF3N2OS MolecularWeight: 424.86705

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SCCC(=O)NC3=C(C=CC(=C3)Cl)C(F)(F)F

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SCCC(=O)NC3=C(C=CC(=C3)Cl)C(F)(F)F

InChI

InChI=1S/C20H16ClF3N2OS/c1-12-10-19(26-16-5-3-2-4-14(12)16)28-9-8-18(27)25-17-11-13(21)6-7-15(17)20(22,23)24/h2-7,10-11H,8-9H2,1H3,(H,25,27)