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Substance Name: Cyclohexanecarboxylic acid, 4(and 5)-methyl-2-(((2-oxotetrahydro-3-thienyl)amino)carbonyl)-
RN: 105441-22-3
InChIKey: ILZWZCIYXAXFSQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H19-N-O4-S

Molecular Weight

  • 285.3621
 
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Names and Synonyms

Synonyms

  • 4(and 5)-Methyl-2-(((2-oxotetrahydro-3-thienyl)amino)carbonyl)cyclohexanecarboxylic acid
  • CHF 1229

Systematic Name

  • Cyclohexanecarboxylic acid, 4(and 5)-methyl-2-(((2-oxotetrahydro-3-thienyl)amino)carbonyl)-

Registry Numbers

CAS Registry Number

  • 105441-22-3

System Generated Number

  • 0105441223

Structure Descriptors

InChI

1S/C13H19NO4S/c1-7-2-3-8(12(16)17)9(6-7)11(15)14-10-4-5-19-13(10)18/h7-10H,2-6H2,1H3,(H,14,15)(H,16,17)

InChIKey

ILZWZCIYXAXFSQ-UHFFFAOYSA-N

Smiles

CC1CCC(C(C1)C(=O)NC2CCSC2=O)C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 4gm/kg (4000mg/kg)   European Patent Application. Vol. #0192191,