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Substance Name: 6-Amino-2-mercapto-5-methylpyrimidine-4-carboxylic acid
RN: 13166-59-1
InChIKey: KXANUQWRDRBGIC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C6-H7-N3-O2-S

Molecular Weight

  • 185.206
 
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Names and Synonyms

Name of Substance

  • 6-Amino-2-mercapto-5-methylpyrimidine-4-carboxylic acid

Synonyms

  • 2-Thio-6-amino-5-methyl-4-carboxy pyrimidine
  • 4-Pyrimidinecarboxylic acid, 1,2-dihydro-6-amino-5-methyl-2-thioxo-
  • 6-Amino-2-mercapto-5-methyl-4-pyrimidinecarboxylic acid
  • BRN 0515667
  • NSC 98528

Systematic Name

  • 4-Pyrimidinecarboxylic acid, 6-amino-2-mercapto-5-methyl-

Registry Numbers

CAS Registry Number

  • 13166-59-1

System Generated Number

  • 0013166591

Structure Descriptors

InChI

1S/C6H7N3O2S/c1-2-3(5(10)11)8-6(12)9-4(2)7/h1H3,(H,10,11)(H3,7,8,9,12)

InChIKey

KXANUQWRDRBGIC-UHFFFAOYSA-N

Smiles

n1c(c(C)c(nc1S)C(=O)O)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 320mg/kg (320mg/kg)   Journal of Pharmaceutical Sciences. Vol. 74, Pg. 759, 1985.
mouse LD50 intravenous 180mg/kg (180mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#04720,