N-[4-(2-ethoxy-2-oxidanylidene-ethyl)-1,3-thiazol-2-yl]-1-ethyl-6-fluoranyl-7-(4-methylpiperazin-4-ium-1-yl)-4-oxidanylidene-quinoline-3-carboximidate

Systemtic Name: N-[4-(2-ethoxy-2-oxidanylidene-ethyl)-1,3-thiazol-2-yl]-1-ethyl-6-fluoranyl-7-(4-methylpiperazin-4-ium-1-yl)-4-oxidanylidene-quinoline-3-carboximidate Openeye Name: N-[4-(2-ethoxy-2-oxo-ethyl)thiazol-2-yl]-1-ethyl-6-fluoro-7-(4-methylpiperazin-4-ium-1-yl)-4-oxo-quinoline-3-carboximidate CAS Name: N-[4-(2-ethoxy-2-oxoethyl)-2-thiazolyl]-1-ethyl-6-fluoro-7-(4-methyl-1-piperazin-4-iumyl)-4-oxo-3-quinolinecarboximidate IUPAC Name: N-[4-(2-ethoxy-2-oxoethyl)-1,3-thiazol-2-yl]-1-ethyl-6-fluoro-7-(4-methylpiperazin-4-ium-1-yl)-4-oxoquinoline-3-carboximidate Traditional Name: N-[4-(2-ethoxy-2-keto-ethyl)thiazol-2-yl]-1-ethyl-6-fluoro-4-keto-7-(4-methylpiperazin-4-ium-1-yl)quinoline-3-carboximidate Formula: C24H28FN5O4S MolecularWeight: 501.573623

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CC[NH+](CC3)C)F)C(=NC4=NC(=CS4)CC(=O)OCC)[O-]

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CC[NH+](CC3)C)F)C(=NC4=NC(=CS4)CC(=O)OCC)[O-]

InChI

InChI=1S/C24H28FN5O4S/c1-4-29-13-17(23(33)27-24-26-15(14-35-24)10-21(31)34-5-2)22(32)16-11-18(25)20(12-19(16)29)30-8-6-28(3)7-9-30/h11-14H,4-10H2,1-3H3,(H,26,27,33)