ethyl 7-[2-[2-(dimethylamino)ethanimidoylsulfanyl]ethanoyl]-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 7-[2-[2-(dimethylamino)ethanimidoylsulfanyl]ethanoyl]-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 7-[2-[2-(dimethylamino)ethanimidoyl]sulfanylacetyl]-1-ethyl-6-fluoro-4-oxo-quinoline-3-carboxylate CAS Name: 7-[2-[[2-(dimethylamino)-1-iminoethyl]thio]-1-oxoethyl]-1-ethyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 7-[2-[2-(dimethylamino)ethanimidoyl]sulfanylacetyl]-1-ethyl-6-fluoro-4-oxoquinoline-3-carboxylate Traditional Name: 7-[2-[[2-(dimethylamino)acetimidoyl]thio]acetyl]-1-ethyl-6-fluoro-4-keto-quinoline-3-carboxylic acid ethyl ester Formula: C20H24FN3O4S MolecularWeight: 421.485663

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)C(=O)CSC(=N)CN(C)C)F)C(=O)OCC

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)C(=O)CSC(=N)CN(C)C)F)C(=O)OCC

InChI

InChI=1S/C20H24FN3O4S/c1-5-24-9-14(20(27)28-6-2)19(26)13-7-15(21)12(8-16(13)24)17(25)11-29-18(22)10-23(3)4/h7-9,22H,5-6,10-11H2,1-4H3