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

Systemtic Name: ethyl 6-fluoranyl-7-(4-methoxyphenyl)-4-oxidanylidene-2-sulfanyl-1H-quinoline-3-carboxylate Openeye Name: ethyl 6-fluoro-7-(4-methoxyphenyl)-4-oxo-2-sulfanyl-1H-quinoline-3-carboxylate CAS Name: 6-fluoro-2-mercapto-7-(4-methoxyphenyl)-4-oxo-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-fluoro-7-(4-methoxyphenyl)-4-oxo-2-sulfanyl-1H-quinoline-3-carboxylate Traditional Name: 6-fluoro-4-keto-2-mercapto-7-(4-methoxyphenyl)-1H-quinoline-3-carboxylic acid ethyl ester Formula: C19H16FNO4S MolecularWeight: 373.398043

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=CC(=C(C=C2C1=O)F)C3=CC=C(C=C3)OC)S

Isomeric SMILES

CCOC(=O)C1=C(NC2=CC(=C(C=C2C1=O)F)C3=CC=C(C=C3)OC)S

InChI

InChI=1S/C19H16FNO4S/c1-3-25-19(23)16-17(22)13-8-14(20)12(9-15(13)21-18(16)26)10-4-6-11(24-2)7-5-10/h4-9H,3H2,1-2H3,(H2,21,22,26)