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Substance Name: Acetic acid, ((2-(2,4-dichlorophenyl)-2-hydroxy-3-(1H-imidazol-1-yl)propyl)thio)-, ethyl ester
RN: 87049-51-2
InChIKey: IEFFAEGROMWRIM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H18-Cl2-N2-O3-S

Molecular Weight

  • 389.3012
 
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Names and Synonyms

Synonyms

  • Ethyl ((2-(2,4-dichlorophenyl)-2-hydroxy-3-(1H-imidazol-1-yl)propyl)thio)acetate
  • Ethyl (2-(2,4-dichlorophenyl)-2-hydroxy-3-(imidazol-1-yl)propylthio)acetate

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 87049-51-2

System Generated Number

  • 0087049512

Structure Descriptors

InChI

1S/C16H18Cl2N2O3S/c1-2-23-15(21)8-24-10-16(22,9-20-6-5-19-11-20)13-4-3-12(17)7-14(13)18/h3-7,11,22H,2,8-10H2,1H3

InChIKey

IEFFAEGROMWRIM-UHFFFAOYSA-N

Smiles

CCOC(=O)CSCC(Cn1ccnc1)(c2ccc(cc2Cl)Cl)O

Toxicity

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