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Substance Name: 4-Thiazolecarboxylic acid, 2-(2-(3,4,5-trimethoxyphenyl)ethenyl)-
RN: 99661-70-8
InChIKey: MLHATLDRACIXFA-SNAWJCMRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H15-N-O5-S

Molecular Weight

  • 321.3515
 
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Names and Synonyms

Synonym

  • 2-(2-(3,4,5-Trimethoxyphenyl)ethenyl)-4-thiazolecarboxylic acid

Systematic Name

  • 4-Thiazolecarboxylic acid, 2-(2-(3,4,5-trimethoxyphenyl)ethenyl)-

Registry Numbers

CAS Registry Number

  • 99661-70-8

System Generated Number

  • 0099661708

Structure Descriptors

InChI

1S/C15H15NO5S/c1-19-11-6-9(7-12(20-2)14(11)21-3)4-5-13-16-10(8-22-13)15(17)18/h4-8H,1-3H3,(H,17,18)/b5-4+

InChIKey

MLHATLDRACIXFA-SNAWJCMRSA-N

Smiles

COc1cc(cc(c1OC)OC)/C=C/c2nc(cs2)C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 500mg/kg (500mg/kg)   Farmaco, Edizione Scientifica. Vol. 40, Pg. 875, 1985.
mouse LD50 oral > 800mg/kg (800mg/kg)   Farmaco, Edizione Scientifica. Vol. 40, Pg. 875, 1985.