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Substance Name: 1,2-Ethanedisulfonic acid, compd. with 5-(chloromethyl)-4-methylthiazole (1:2)
RN: 18067-26-0
InChIKey: IYFYACJKWQGMGU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C2-H6-O6-S2.Cl0-H12-Cl2-N2-S2

Molecular Weight

  • 485.452
 
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Names and Synonyms

Synonym

  • 5-Chloromethyl-4-methylthiazole compd. with 1,2-ethanedisulfonic acid (2:1)

Systematic Name

  • 1,2-Ethanedisulfonic acid, compd. with 5-(chloromethyl)-4-methylthiazole (1:2)

Registry Numbers

CAS Registry Number

  • 18067-26-0

System Generated Number

  • 0018067260

Molecular Formulas

Molecular Formula

  • C2-H6-O6-S2.Cl0-H12-Cl2-N2-S2

Molecular Formula Fragments

  • C2-H6-O6-S2
  • Cl0-H12-Cl2-N2-S2
  • COMPONENT

Structure Descriptors

InChI

1S/2C5H6ClNS.C2H6O6S2/c2*1-4-5(2-6)8-3-7-4;3-9(4,5)1-2-10(6,7)8/h2*3H,2H2,1H3;1-2H2,(H,3,4,5)(H,6,7,8)

InChIKey

IYFYACJKWQGMGU-UHFFFAOYSA-N

Smiles

s1cnc(c1CCl)C.C(CS(=O)(=O)O)S(=O)(=O)O.s1c(CCl)c(C)nc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 2gm/kg (2000mg/kg)   Acta Pharmaceutica Suecica. Vol. 4, Pg. 269, 1967.