1-cyclopropyl-7-(4-ethylpiperazin-4-ium-1-yl)-6-fluoranyl-4-oxidanylidene-N-(1,3-thiazol-2-yl)quinoline-3-carboximidate

Systemtic Name: 1-cyclopropyl-7-(4-ethylpiperazin-4-ium-1-yl)-6-fluoranyl-4-oxidanylidene-N-(1,3-thiazol-2-yl)quinoline-3-carboximidate Openeye Name: 1-cyclopropyl-7-(4-ethylpiperazin-4-ium-1-yl)-6-fluoro-4-oxo-N-thiazol-2-yl-quinoline-3-carboximidate CAS Name: 1-cyclopropyl-7-(4-ethyl-1-piperazin-4-iumyl)-6-fluoro-4-oxo-N-(2-thiazolyl)-3-quinolinecarboximidate IUPAC Name: 1-cyclopropyl-7-(4-ethylpiperazin-4-ium-1-yl)-6-fluoro-4-oxo-N-(1,3-thiazol-2-yl)quinoline-3-carboximidate Traditional Name: 1-cyclopropyl-7-(4-ethylpiperazin-4-ium-1-yl)-6-fluoro-4-keto-N-thiazol-2-yl-quinoline-3-carboximidate Formula: C22H24FN5O2S MolecularWeight: 441.521663

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=NC4=NC=CS4)[O-])C5CC5)F

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=NC4=NC=CS4)[O-])C5CC5)F

InChI

InChI=1S/C22H24FN5O2S/c1-2-26-6-8-27(9-7-26)19-12-18-15(11-17(19)23)20(29)16(13-28(18)14-3-4-14)21(30)25-22-24-5-10-31-22/h5,10-14H,2-4,6-9H2,1H3,(H,24,25,30)