ethyl 6,7-bis(fluoranyl)-4-oxidanylidene-2-sulfanyl-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 6,7-bis(fluoranyl)-4-oxidanylidene-2-sulfanyl-1H-quinoline-3-carboxylate Openeye Name: ethyl 6,7-difluoro-4-oxo-2-sulfanyl-1H-quinoline-3-carboxylate CAS Name: 6,7-difluoro-2-mercapto-4-oxo-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6,7-difluoro-4-oxo-2-sulfanyl-1H-quinoline-3-carboxylate Traditional Name: 6,7-difluoro-4-keto-2-mercapto-1H-quinoline-3-carboxylic acid ethyl ester Formula: C12H9F2NO3S MolecularWeight: 285.266566

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=CC(=C(C=C2C1=O)F)F)S

Isomeric SMILES

CCOC(=O)C1=C(NC2=CC(=C(C=C2C1=O)F)F)S

InChI

InChI=1S/C12H9F2NO3S/c1-2-18-12(17)9-10(16)5-3-6(13)7(14)4-8(5)15-11(9)19/h3-4H,2H2,1H3,(H2,15,16,19)