1-ethyl-6-fluoranyl-7-(1-methylimidazol-2-yl)sulfanyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-ethyl-6-fluoranyl-7-(1-methylimidazol-2-yl)sulfanyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-ethyl-6-fluoro-7-(1-methylimidazol-2-yl)sulfanyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-ethyl-6-fluoro-7-[(1-methyl-2-imidazolyl)thio]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-ethyl-6-fluoro-7-(1-methylimidazol-2-yl)sulfanyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-ethyl-6-fluoro-4-keto-7-[(1-methylimidazol-2-yl)thio]quinoline-3-carboxylic acid Formula: C16H14FN3O3S MolecularWeight: 347.364063

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)SC3=NC=CN3C)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)SC3=NC=CN3C)F)C(=O)O

InChI

InChI=1S/C16H14FN3O3S/c1-3-20-8-10(15(22)23)14(21)9-6-11(17)13(7-12(9)20)24-16-18-4-5-19(16)2/h4-8H,3H2,1-2H3,(H,22,23)