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Substance Name: 2,4(1H,3H)-Pyrimidinedione, 5-fluoro-1-((3-nitro-4-propoxyphenyl)sulfonyl)-
RN: 128887-35-4
InChIKey: RCEHOLIATAHQOL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H12-F-N3-O7-S

Molecular Weight

  • 373.3158
 
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Names and Synonyms

Synonyms

  • 5-Fluoro-1-((3-nitro-4-propoxyphenyl)sulfonyl)-2,4(1H,3H)-pyrimidinedione
  • BRN 4336760
  • N'-(3-Nitro-4-propoxybenzenesulfonyl)-5-fluorouracil

Systematic Name

  • 2,4(1H,3H)-Pyrimidinedione, 5-fluoro-1-((3-nitro-4-propoxyphenyl)sulfonyl)-

Registry Numbers

CAS Registry Number

  • 128887-35-4

System Generated Number

  • 0128887354

Structure Descriptors

InChI

1S/C13H12FN3O7S/c1-2-5-24-11-4-3-8(6-10(11)17(20)21)25(22,23)16-7-9(14)12(18)15-13(16)19/h3-4,6-7H,2,5H2,1H3,(H,15,18,19)

InChIKey

RCEHOLIATAHQOL-UHFFFAOYSA-N

Smiles

CCCOc1ccc(cc1[N+](=O)[O-])S(=O)(=O)n2cc(c(=O)[nH]c2=O)F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1gm/kg (1000mg/kg)   Khimiko-Farmatsevticheskii Zhurnal. Chemical Pharmaceutical Journal. For English translation, see PCJOAU. Vol. 24(3), Pg. 37, 1990.