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Substance Name: 5-Thiazoleacetic acid, 2-(2-(1,3-benzodioxol-5-yl)ethenyl)-4-phenyl-
RN: 116759-24-1
InChIKey: OLKKPXSWVVFUGO-VQHVLOKHSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H15-N-O4-S

Molecular Weight

  • 365.4075
 
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Names and Synonyms

Synonym

  • 2-(2-(1,3-Benzodioxol-5-yl)ethenyl)-4-phenyl-5-thiazoleacetic acid

Systematic Name

  • 5-Thiazoleacetic acid, 2-(2-(1,3-benzodioxol-5-yl)ethenyl)-4-phenyl-

Registry Numbers

CAS Registry Number

  • 116759-24-1

System Generated Number

  • 0116759241

Structure Descriptors

InChI

1S/C20H15NO4S/c22-19(23)11-17-20(14-4-2-1-3-5-14)21-18(26-17)9-7-13-6-8-15-16(10-13)25-12-24-15/h1-10H,11-12H2,(H,22,23)/b9-7+

InChIKey

OLKKPXSWVVFUGO-VQHVLOKHSA-N

Smiles

c1ccc(cc1)c2c(sc(n2)/C=C/c3ccc4c(c3)OCO4)CC(=O)O

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.