4-[2-[7-methoxy-4-(trifluoromethyl)quinolin-2-yl]sulfanylethanoyl]-1,3-dihydroquinoxalin-2-one

Systemtic Name: 4-[2-[7-methoxy-4-(trifluoromethyl)quinolin-2-yl]sulfanylethanoyl]-1,3-dihydroquinoxalin-2-one Openeye Name: 4-[2-[[7-methoxy-4-(trifluoromethyl)-2-quinolyl]sulfanyl]acetyl]-1,3-dihydroquinoxalin-2-one CAS Name: 4-[2-[[7-methoxy-4-(trifluoromethyl)-2-quinolinyl]thio]-1-oxoethyl]-1,3-dihydroquinoxalin-2-one IUPAC Name: 4-[2-[7-methoxy-4-(trifluoromethyl)quinolin-2-yl]sulfanylacetyl]-1,3-dihydroquinoxalin-2-one Traditional Name: 4-[2-[[7-methoxy-4-(trifluoromethyl)-2-quinolyl]thio]acetyl]-1,3-dihydroquinoxalin-2-one Formula: C21H16F3N3O3S MolecularWeight: 447.43025

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=N2)SCC(=O)N3CC(=O)NC4=CC=CC=C43)C(F)(F)F

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=N2)SCC(=O)N3CC(=O)NC4=CC=CC=C43)C(F)(F)F

InChI

InChI=1S/C21H16F3N3O3S/c1-30-12-6-7-13-14(21(22,23)24)9-19(26-16(13)8-12)31-11-20(29)27-10-18(28)25-15-4-2-3-5-17(15)27/h2-9H,10-11H2,1H3,(H,25,28)