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

Systemtic Name: ethyl 7-[4-(aminomethyl)-1,3-thiazol-2-yl]-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 7-[4-(aminomethyl)thiazol-2-yl]-1-ethyl-6-fluoro-4-oxo-quinoline-3-carboxylate CAS Name: 7-[4-(aminomethyl)-2-thiazolyl]-1-ethyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 7-[4-(aminomethyl)-1,3-thiazol-2-yl]-1-ethyl-6-fluoro-4-oxoquinoline-3-carboxylate Traditional Name: 7-[4-(aminomethyl)thiazol-2-yl]-1-ethyl-6-fluoro-4-keto-quinoline-3-carboxylic acid ethyl ester Formula: C18H18FN3O3S MolecularWeight: 375.417223

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18FN3O3S/c1-3-22-8-13(18(24)25-4-2)16(23)12-5-14(19)11(6-15(12)22)17-21-10(7-20)9-26-17/h5-6,8-9H,3-4,7,20H2,1-2H3