ethyl 1-ethyl-6-fluoranyl-7-(2-morpholin-4-yl-1,3-thiazol-4-yl)-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 1-ethyl-6-fluoranyl-7-(2-morpholin-4-yl-1,3-thiazol-4-yl)-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 1-ethyl-6-fluoro-7-(2-morpholinothiazol-4-yl)-4-oxo-quinoline-3-carboxylate CAS Name: 1-ethyl-6-fluoro-7-[2-(4-morpholinyl)-4-thiazolyl]-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-6-fluoro-7-(2-morpholin-4-yl-1,3-thiazol-4-yl)-4-oxoquinoline-3-carboxylate Traditional Name: 1-ethyl-6-fluoro-4-keto-7-(2-morpholinothiazol-4-yl)quinoline-3-carboxylic acid ethyl ester Formula: C21H22FN3O4S MolecularWeight: 431.480483

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)C3=CSC(=N3)N4CCOCC4)F)C(=O)OCC

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)C3=CSC(=N3)N4CCOCC4)F)C(=O)OCC

InChI

InChI=1S/C21H22FN3O4S/c1-3-24-11-15(20(27)29-4-2)19(26)14-9-16(22)13(10-18(14)24)17-12-30-21(23-17)25-5-7-28-8-6-25/h9-12H,3-8H2,1-2H3