N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-2-quinolin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-2-quinolin-2-ylsulfanyl-ethanamide Openeye Name: N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-2-(2-quinolylsulfanyl)acetamide CAS Name: N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-2-(2-quinolinylthio)acetamide IUPAC Name: N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-2-quinolin-2-ylsulfanylacetamide Traditional Name: N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-2-(2-quinolylthio)acetamide Formula: C21H19F3N2O3S MolecularWeight: 436.44737

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C(C=C1)C(F)(F)F)NC(=O)CSC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

COCCOC1=C(C=C(C=C1)C(F)(F)F)NC(=O)CSC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C21H19F3N2O3S/c1-28-10-11-29-18-8-7-15(21(22,23)24)12-17(18)25-19(27)13-30-20-9-6-14-4-2-3-5-16(14)26-20/h2-9,12H,10-11,13H2,1H3,(H,25,27)