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Substance Name: Benzenesulfonic acid, 4-fluoro-, 5-(aminocarbonyl)-1H-imidazol-4-yl ester
RN: 78682-27-6
InChIKey: LKPTUPAJBXARSW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H8-F-N3-O4-S

Molecular Weight

  • 285.2542
 
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Names and Synonyms

Synonyms

  • 5-(Aminocarbonyl)-1H-imidazol-4-yl 4-fluorobenzenesulfonate
  • 5-Carbamoyl-1H-imidazole-4-yl 4'-fluorobenzenesulfonate

Systematic Name

  • Benzenesulfonic acid, 4-fluoro-, 5-(aminocarbonyl)-1H-imidazol-4-yl ester

Registry Numbers

CAS Registry Number

  • 78682-27-6

System Generated Number

  • 0078682276

Structure Descriptors

InChI

1S/C10H8FN3O4S/c11-6-1-3-7(4-2-6)19(16,17)18-10-8(9(12)15)13-5-14-10/h1-5H,(H2,12,15)(H,13,14)

InChIKey

LKPTUPAJBXARSW-UHFFFAOYSA-N

Smiles

c1cc(ccc1F)S(=O)(=O)Oc2c([nH]cn2)C(=O)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 1gm/kg (1000mg/kg)   European Patent Application. Vol. #0024172,