ethyl 6,7,8-tris(fluoranyl)-1-(2-methylpyridin-4-yl)-2-methylsulfanyl-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 6,7,8-tris(fluoranyl)-1-(2-methylpyridin-4-yl)-2-methylsulfanyl-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 6,7,8-trifluoro-1-(2-methyl-4-pyridyl)-2-methylsulfanyl-4-oxo-quinoline-3-carboxylate CAS Name: 6,7,8-trifluoro-1-(2-methyl-4-pyridinyl)-2-(methylthio)-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6,7,8-trifluoro-1-(2-methylpyridin-4-yl)-2-methylsulfanyl-4-oxoquinoline-3-carboxylate Traditional Name: 6,7,8-trifluoro-4-keto-1-(2-methyl-4-pyridyl)-2-(methylthio)quinoline-3-carboxylic acid ethyl ester Formula: C19H15F3N2O3S MolecularWeight: 408.39421

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C(C(=C(C=C2C1=O)F)F)F)C3=CC(=NC=C3)C)SC

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C(C(=C(C=C2C1=O)F)F)F)C3=CC(=NC=C3)C)SC

InChI

InChI=1S/C19H15F3N2O3S/c1-4-27-19(26)13-17(25)11-8-12(20)14(21)15(22)16(11)24(18(13)28-3)10-5-6-23-9(2)7-10/h5-8H,4H2,1-3H3