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Substance Name: 4-Isothiazolecarboxamide, N-(4-chlorophenyl)-3-methyl-5-((1-oxopropyl)amino)-
RN: 154807-52-0
InChIKey: VCGKLXVHYFHMMN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H14-Cl-N3-O2-S

Molecular Weight

  • 323.8026
 
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Names and Synonyms

Synonyms

  • 3-Methyl-5-propionylaminoisothiazole-4-carboxylic acid p-chloroanilide
  • N-(4-Chlorophenyl)-3-methyl-5-((1-oxopropyl)amino)-4-isothiazolecarboxamide

Systematic Name

  • 4-Isothiazolecarboxamide, N-(4-chlorophenyl)-3-methyl-5-((1-oxopropyl)amino)-

Registry Numbers

CAS Registry Number

  • 154807-52-0

System Generated Number

  • 0154807520

Structure Descriptors

InChI

1S/C14H14ClN3O2S/c1-3-11(19)17-14-12(8(2)18-21-14)13(20)16-10-6-4-9(15)5-7-10/h4-7H,3H2,1-2H3,(H,16,20)(H,17,19)

InChIKey

VCGKLXVHYFHMMN-UHFFFAOYSA-N

Smiles

CCC(=O)Nc1c(c(ns1)C)C(=O)Nc2ccc(cc2)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 700mg/kg (700mg/kg)   Pharmazie. Vol. 47, Pg. 492, 1992.