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Substance Name: Thiazole-5-acetic acid, 4-(p-chlorophenyl)-2-(o-methoxy-alpha-sulfobenzylamino)-, methyl ester
RN: 102628-31-9
InChIKey: XNTPERBOPOADTJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H19-Cl-N2-O6-S2

Molecular Weight

  • 482.9631
 
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Names and Synonyms

Synonym

  • 2-p-Methoxybenzylamino-alpha-sulpho-4-p-chlorophenyl thiazole-5-acetic acid methyl ester

Systematic Name

  • Thiazole-5-acetic acid, 4-(p-chlorophenyl)-2-(o-methoxy-alpha-sulfobenzylamino)-, methyl ester

Registry Numbers

CAS Registry Number

  • 102628-31-9

System Generated Number

  • 0102628319

Structure Descriptors

InChI

1S/C20H19ClN2O6S2/c1-28-16-6-4-3-5-14(16)12-23(31(25,26)27)20-22-19(13-7-9-15(21)10-8-13)17(30-20)11-18(24)29-2/h3-10H,11-12H2,1-2H3,(H,25,26,27)

InChIKey

XNTPERBOPOADTJ-UHFFFAOYSA-N

Smiles

COc1ccccc1CN(c2nc(c(s2)CC(=O)OC)c3ccc(cc3)Cl)S(=O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 670mg/kg (670mg/kg)   Archivum Immunologiae et Therapiae Experimentalis. Vol. 27, Pg. 795, 1979.