[1-(chloromethyl)-3-(5-fluoranyl-1,3-benzothiazol-2-yl)-3-oxidanidyl-imidazolidin-3-ium-4-yl] furan-3-carboxylate

Systemtic Name: [1-(chloromethyl)-3-(5-fluoranyl-1,3-benzothiazol-2-yl)-3-oxidanidyl-imidazolidin-3-ium-4-yl] furan-3-carboxylate Openeye Name: [1-(chloromethyl)-3-(5-fluoro-1,3-benzothiazol-2-yl)-3-oxido-imidazolidin-3-ium-4-yl] furan-3-carboxylate CAS Name: 3-furancarboxylic acid [1-(chloromethyl)-3-(5-fluoro-1,3-benzothiazol-2-yl)-3-oxido-4-imidazolidin-3-iumyl] ester IUPAC Name: [1-(chloromethyl)-3-(5-fluoro-1,3-benzothiazol-2-yl)-3-oxidoimidazolidin-3-ium-4-yl] furan-3-carboxylate Traditional Name: furan-3-carboxylic acid [1-(chloromethyl)-3-(5-fluoro-1,3-benzothiazol-2-yl)-3-oxido-imidazolidin-3-ium-4-yl] ester Formula: C16H13ClFN3O4S MolecularWeight: 397.808523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C([N+](CN1CCl)(C2=NC3=C(S2)C=CC(=C3)F)[O-])OC(=O)C4=COC=C4

Isomeric SMILES

C1C([N+](CN1CCl)(C2=NC3=C(S2)C=CC(=C3)F)[O-])OC(=O)C4=COC=C4

InChI

InChI=1S/C16H13ClFN3O4S/c17-8-20-6-14(25-15(22)10-3-4-24-7-10)21(23,9-20)16-19-12-5-11(18)1-2-13(12)26-16/h1-5,7,14H,6,8-9H2