[2-oxidanylidene-2-(quinolin-5-ylamino)ethyl] 4-(trifluoromethylsulfanyl)benzoate

Systemtic Name: [2-oxidanylidene-2-(quinolin-5-ylamino)ethyl] 4-(trifluoromethylsulfanyl)benzoate Openeye Name: [2-oxo-2-(5-quinolylamino)ethyl] 4-(trifluoromethylsulfanyl)benzoate CAS Name: 4-(trifluoromethylthio)benzoic acid [2-oxo-2-(5-quinolinylamino)ethyl] ester IUPAC Name: [2-oxo-2-(quinolin-5-ylamino)ethyl] 4-(trifluoromethylsulfanyl)benzoate Traditional Name: 4-(trifluoromethylthio)benzoic acid [2-keto-2-(5-quinolylamino)ethyl] ester Formula: C19H13F3N2O3S MolecularWeight: 406.37833

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC=N2)C(=C1)NC(=O)COC(=O)C3=CC=C(C=C3)SC(F)(F)F

Isomeric SMILES

C1=CC2=C(C=CC=N2)C(=C1)NC(=O)COC(=O)C3=CC=C(C=C3)SC(F)(F)F

InChI

InChI=1S/C19H13F3N2O3S/c20-19(21,22)28-13-8-6-12(7-9-13)18(26)27-11-17(25)24-16-5-1-4-15-14(16)3-2-10-23-15/h1-10H,11H2,(H,24,25)