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Substance Name: Propanoic acid, 2-(4-((1-((4-hydroxyphenyl)thio)-1-methylethyl)thio)phenoxy)-2-methyl-, ethyl ester
RN: 99661-86-6
InChIKey: WJXXCBCXEHGZDY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H26-O4-S2

Molecular Weight

  • 406.5644
 
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Names and Synonyms

Synonyms

  • 2-(4-Idrossifenilmercapto)-2-(4-(alpha-etossicarbonilisopropossi)fenilmercapto)propano
  • MG 6878

Systematic Name

  • Propanoic acid, 2-(4-((1-((4-hydroxyphenyl)thio)-1-methylethyl)thio)phenoxy)-2-methyl-, ethyl ester

Registry Numbers

CAS Registry Number

  • 99661-86-6

System Generated Number

  • 0099661866

Structure Descriptors

InChI

1S/C21H26O4S2/c1-6-24-19(23)20(2,3)25-16-9-13-18(14-10-16)27-21(4,5)26-17-11-7-15(22)8-12-17/h7-14,22H,6H2,1-5H3

InChIKey

WJXXCBCXEHGZDY-UHFFFAOYSA-N

Smiles

CCOC(=O)C(C)(C)Oc1ccc(cc1)SC(C)(C)Sc2ccc(cc2)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 400mg/kg (400mg/kg)   Farmaco, Edizione Scientifica. Vol. 40, Pg. 833, 1985.