ethyl 6,7-bis(fluoranyl)-2-methylsulfanyl-4-oxidanylidene-1-pyridin-4-yl-quinoline-3-carboxylate

Systemtic Name: ethyl 6,7-bis(fluoranyl)-2-methylsulfanyl-4-oxidanylidene-1-pyridin-4-yl-quinoline-3-carboxylate Openeye Name: ethyl 6,7-difluoro-2-methylsulfanyl-4-oxo-1-(4-pyridyl)quinoline-3-carboxylate CAS Name: 6,7-difluoro-2-(methylthio)-4-oxo-1-pyridin-4-yl-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6,7-difluoro-2-methylsulfanyl-4-oxo-1-pyridin-4-ylquinoline-3-carboxylate Traditional Name: 6,7-difluoro-4-keto-2-(methylthio)-1-(4-pyridyl)quinoline-3-carboxylic acid ethyl ester Formula: C18H14F2N2O3S MolecularWeight: 376.377166

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14F2N2O3S/c1-3-25-18(24)15-16(23)11-8-12(19)13(20)9-14(11)22(17(15)26-2)10-4-6-21-7-5-10/h4-9H,3H2,1-2H3