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Substance Name: Thiazole, 4,5-bis(4-methoxyphenyl)-2-(1-(2,2,2-trifluoroethyl)-1H-pyrrol-2-yl)-
RN: 101001-32-5
InChIKey: MERCFOKQWJJQMA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H19-F3-N2-O2-S

Molecular Weight

  • 444.4751
 
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Names and Synonyms

Synonyms

  • 4,5-Bis(4-methoxyphenyl)-2-(1-(2,2,2-trifluoroethyl)-1H-pyrrol-2-yl)thiazole
  • 4,5-Bis(4-methoxyphenyl)-2-(1-(2,2,2-trifluoroethyl)-pyrrol-2-yl)thiazole

Systematic Name

  • Thiazole, 4,5-bis(4-methoxyphenyl)-2-(1-(2,2,2-trifluoroethyl)-1H-pyrrol-2-yl)-

Registry Numbers

CAS Registry Number

  • 101001-32-5

System Generated Number

  • 0101001325

Structure Descriptors

InChI

1S/C23H19F3N2O2S/c1-29-17-9-5-15(6-10-17)20-21(16-7-11-18(30-2)12-8-16)31-22(27-20)19-4-3-13-28(19)14-23(24,25)26/h3-13H,14H2,1-2H3

InChIKey

MERCFOKQWJJQMA-UHFFFAOYSA-N

Smiles

COc1ccc(cc1)c2c(sc(n2)c3cccn3CC(F)(F)F)c4ccc(cc4)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 3gm/kg (3000mg/kg)   United States Patent Document. Vol. #4659726,