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Substance Name: Acetic acid, ((2-(2,4-dichlorophenyl)-2-hydroxy-3-(1H-imidazol-1-yl)propyl)thio)-
RN: 87049-52-3
InChIKey: ZRNDGQMFNWQSDV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H14-Cl2-N2-O3-S

Molecular Weight

  • 361.2476
 
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Names and Synonyms

Synonyms

  • ((2-(2,4-Dichlorophenyl)-2-hydroxy-3-(1H-imidazol-1-yl)propyl)thio)acetic acid
  • (2-(2,4-Dichlorophenyl)-2-hydroxy-3-(imidazol-1-yl)propylthio)acetic acid

Systematic Name

  • Acetic acid, ((2-(2,4-dichlorophenyl)-2-hydroxy-3-(1H-imidazol-1-yl)propyl)thio)-

Registry Numbers

CAS Registry Number

  • 87049-52-3

System Generated Number

  • 0087049523

Structure Descriptors

InChI

1S/C14H14Cl2N2O3S/c15-10-1-2-11(12(16)5-10)14(21,8-22-6-13(19)20)7-18-4-3-17-9-18/h1-5,9,21H,6-8H2,(H,19,20)

InChIKey

ZRNDGQMFNWQSDV-UHFFFAOYSA-N

Smiles

c1cc(c(cc1Cl)Cl)C(Cn2ccnc2)(CSCC(=O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 500mg/kg (500mg/kg)   European Patent Application. Vol. #0077037,