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Substance Name: 1-Cyclohexene-1-carboxylic acid, 2-((5-methyl-1,3,4-thiadiazol-2-yl)amino)-
RN: 160893-95-8
InChIKey: PNBIMFZPQSYRHT-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H13-N3-O2-S

Molecular Weight

  • 239.2977
 
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Names and Synonyms

Synonym

  • 2-((5-Methyl-1,3,4-thiadiazol-2-yl)amino)-1-cyclohexene-1-carboxylic acid

Systematic Name

  • 1-Cyclohexene-1-carboxylic acid, 2-((5-methyl-1,3,4-thiadiazol-2-yl)amino)-

Registry Numbers

CAS Registry Number

  • 160893-95-8

System Generated Number

  • 0160893958

Structure Descriptors

InChI

1S/C10H13N3O2S/c1-6-12-13-10(16-6)11-8-5-3-2-4-7(8)9(14)15/h2-5H2,1H3,(H,11,13)(H,14,15)

InChIKey

PNBIMFZPQSYRHT-UHFFFAOYSA-N

Smiles

Cc1nnc(s1)NC2=C(CCCC2)C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 500mg/kg (500mg/kg)   Pharmazie. Vol. 49, Pg. 880, 1994.
mouse LD50 oral > 1gm/kg (1000mg/kg)   Pharmazie. Vol. 49, Pg. 880, 1994.