[1-[6-carboxy-3-fluoranyl-5-oxidanylidene-8-(4-phenyl-1,3-thiazol-2-yl)-1,8-naphthyridin-2-yl]pyrrolidin-3-yl]azanium chloride

Systemtic Name: [1-[6-carboxy-3-fluoranyl-5-oxidanylidene-8-(4-phenyl-1,3-thiazol-2-yl)-1,8-naphthyridin-2-yl]pyrrolidin-3-yl]azanium chloride Openeye Name: [1-[6-carboxy-3-fluoro-5-oxo-8-(4-phenylthiazol-2-yl)-1,8-naphthyridin-2-yl]pyrrolidin-3-yl]ammonium chloride CAS Name: [1-[6-carboxy-3-fluoro-5-oxo-8-(4-phenyl-2-thiazolyl)-1,8-naphthyridin-2-yl]-3-pyrrolidinyl]ammonium chloride IUPAC Name: [1-[6-carboxy-3-fluoro-5-oxo-8-(4-phenyl-1,3-thiazol-2-yl)-1,8-naphthyridin-2-yl]pyrrolidin-3-yl]azanium chloride Traditional Name: [1-[6-carboxy-3-fluoro-5-keto-8-(4-phenylthiazol-2-yl)-1,8-naphthyridin-2-yl]pyrrolidin-3-yl]ammonium chloride Formula: C22H19ClFN5O3S MolecularWeight: 487.934363

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1[NH3+])C2=C(C=C3C(=O)C(=CN(C3=N2)C4=NC(=CS4)C5=CC=CC=C5)C(=O)O)F.[Cl-]

Isomeric SMILES

C1CN(CC1[NH3+])C2=C(C=C3C(=O)C(=CN(C3=N2)C4=NC(=CS4)C5=CC=CC=C5)C(=O)O)F.[Cl-]

InChI

InChI=1S/C22H18FN5O3S.ClH/c23-16-8-14-18(29)15(21(30)31)10-28(19(14)26-20(16)27-7-6-13(24)9-27)22-25-17(11-32-22)12-4-2-1-3-5-12;/h1-5,8,10-11,13H,6-7,9,24H2,(H,30,31);1H