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Substance Name: 4-Thiazolecarboxylic acid, 2-(2-(4-methoxy-3-(2-propenyloxy)phenyl)ethenyl)-
RN: 99661-67-3
InChIKey: XGPNVDQVZLZOAX-FNORWQNLSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H15-N-O4-S

Molecular Weight

  • 317.3635
 
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Names and Synonyms

Synonym

  • 2-(2-(4-Methoxy-3-(2-propenyloxy)phenyl)ethenyl)-4-thiazolecarboxylic acid

Systematic Name

  • 4-Thiazolecarboxylic acid, 2-(2-(4-methoxy-3-(2-propenyloxy)phenyl)ethenyl)-

Registry Numbers

CAS Registry Number

  • 99661-67-3

System Generated Number

  • 0099661673

Structure Descriptors

InChI

1S/C16H15NO4S/c1-3-8-21-14-9-11(4-6-13(14)20-2)5-7-15-17-12(10-22-15)16(18)19/h3-7,9-10H,1,8H2,2H3,(H,18,19)/b7-5+

InChIKey

XGPNVDQVZLZOAX-FNORWQNLSA-N

Smiles

COc1ccc(cc1OCC=C)/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.