ethyl 6-(2-azanylethylsulfanyl)-8-fluoranyl-4-oxidanylidene-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 6-(2-azanylethylsulfanyl)-8-fluoranyl-4-oxidanylidene-1H-quinoline-3-carboxylate Openeye Name: ethyl 6-(2-aminoethylsulfanyl)-8-fluoro-4-oxo-1H-quinoline-3-carboxylate CAS Name: 6-(2-aminoethylthio)-8-fluoro-4-oxo-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(2-aminoethylsulfanyl)-8-fluoro-4-oxo-1H-quinoline-3-carboxylate Traditional Name: 6-(2-aminoethylthio)-8-fluoro-4-keto-1H-quinoline-3-carboxylic acid ethyl ester Formula: C14H15FN2O3S MolecularWeight: 310.343903

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CNC2=C(C=C(C=C2C1=O)SCCN)F

Isomeric SMILES

CCOC(=O)C1=CNC2=C(C=C(C=C2C1=O)SCCN)F

InChI

InChI=1S/C14H15FN2O3S/c1-2-20-14(19)10-7-17-12-9(13(10)18)5-8(6-11(12)15)21-4-3-16/h5-7H,2-4,16H2,1H3,(H,17,18)