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Substance Name: 5-Thiazoleacetic acid, 2-(2-(2,4-dichlorophenyl)ethenyl)-4-(4-fluorophenyl)-
RN: 116759-00-3
InChIKey: KQCDMDVBCZGTGN-XBXARRHUSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H12-Cl2-F-N-O2-S

Molecular Weight

  • 408.2788
 
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Names and Synonyms

Synonym

  • 2-(2-(2,4-Dichlorophenyl)ethenyl)-4-(4-fluorophenyl)-5-thiazoleacetic acid

Systematic Name

  • 5-Thiazoleacetic acid, 2-(2-(2,4-dichlorophenyl)ethenyl)-4-(4-fluorophenyl)-

Registry Numbers

CAS Registry Number

  • 116759-00-3

System Generated Number

  • 0116759003

Structure Descriptors

InChI

1S/C19H12Cl2FNO2S/c20-13-5-1-11(15(21)9-13)4-8-17-23-19(16(26-17)10-18(24)25)12-2-6-14(22)7-3-12/h1-9H,10H2,(H,24,25)/b8-4+

InChIKey

KQCDMDVBCZGTGN-XBXARRHUSA-N

Smiles

c1cc(ccc1c2c(sc(n2)/C=C/c3ccc(cc3Cl)Cl)CC(=O)O)F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 500mg/kg (500mg/kg)   Farmaco, Edizione Scientifica. Vol. 42, Pg. 905, 1987.
mouse LD oral > 1gm/kg (1000mg/kg)   Farmaco, Edizione Scientifica. Vol. 42, Pg. 905, 1987.