N-[2-[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]ethyl]-2-quinolin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[2-[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]ethyl]-2-quinolin-2-ylsulfanyl-ethanamide Openeye Name: N-[2-[4-(difluoromethoxy)-3-methoxy-phenyl]ethyl]-2-(2-quinolylsulfanyl)acetamide CAS Name: N-[2-[4-(difluoromethoxy)-3-methoxyphenyl]ethyl]-2-(2-quinolinylthio)acetamide IUPAC Name: N-[2-[4-(difluoromethoxy)-3-methoxyphenyl]ethyl]-2-quinolin-2-ylsulfanylacetamide Traditional Name: N-[2-[4-(difluoromethoxy)-3-methoxy-phenyl]ethyl]-2-(2-quinolylthio)acetamide Formula: C21H20F2N2O3S MolecularWeight: 418.456906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CCNC(=O)CSC2=NC3=CC=CC=C3C=C2)OC(F)F

Isomeric SMILES

COC1=C(C=CC(=C1)CCNC(=O)CSC2=NC3=CC=CC=C3C=C2)OC(F)F

InChI

InChI=1S/C21H20F2N2O3S/c1-27-18-12-14(6-8-17(18)28-21(22)23)10-11-24-19(26)13-29-20-9-7-15-4-2-3-5-16(15)25-20/h2-9,12,21H,10-11,13H2,1H3,(H,24,26)