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

Systemtic Name: ethyl 1-ethyl-6-fluoranyl-4-oxidanylidene-7-(4-pyridin-2-yl-1,3-thiazol-2-yl)quinoline-3-carboxylate Openeye Name: ethyl 1-ethyl-6-fluoro-4-oxo-7-[4-(2-pyridyl)thiazol-2-yl]quinoline-3-carboxylate CAS Name: 1-ethyl-6-fluoro-4-oxo-7-[4-(2-pyridinyl)-2-thiazolyl]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-6-fluoro-4-oxo-7-(4-pyridin-2-yl-1,3-thiazol-2-yl)quinoline-3-carboxylate Traditional Name: 1-ethyl-6-fluoro-4-keto-7-[4-(2-pyridyl)thiazol-2-yl]quinoline-3-carboxylic acid ethyl ester Formula: C22H18FN3O3S MolecularWeight: 423.460023

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)C3=NC(=CS3)C4=CC=CC=N4)F)C(=O)OCC

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)C3=NC(=CS3)C4=CC=CC=N4)F)C(=O)OCC

InChI

InChI=1S/C22H18FN3O3S/c1-3-26-11-15(22(28)29-4-2)20(27)14-9-16(23)13(10-19(14)26)21-25-18(12-30-21)17-7-5-6-8-24-17/h5-12H,3-4H2,1-2H3