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

Systemtic Name: ethyl 7-[2-(2-acetamidoethyl)-1,3-thiazol-4-yl]-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 7-[2-(2-acetamidoethyl)thiazol-4-yl]-1-ethyl-6-fluoro-4-oxo-quinoline-3-carboxylate CAS Name: 7-[2-(2-acetamidoethyl)-4-thiazolyl]-1-ethyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 7-[2-(2-acetamidoethyl)-1,3-thiazol-4-yl]-1-ethyl-6-fluoro-4-oxoquinoline-3-carboxylate Traditional Name: 7-[2-(2-acetamidoethyl)thiazol-4-yl]-1-ethyl-6-fluoro-4-keto-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)CCNC(=O)C)F)C(=O)OCC

Isomeric SMILES

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

InChI

InChI=1S/C21H22FN3O4S/c1-4-25-10-15(21(28)29-5-2)20(27)14-8-16(22)13(9-18(14)25)17-11-30-19(24-17)6-7-23-12(3)26/h8-11H,4-7H2,1-3H3,(H,23,26)