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Substance Name: 4-Thiazolidinecarboxamide, N,N'-(dithiodi-2,1-ethanediyl)bis-, (R-(R*,R*))-, bis(trifluoroacetate)
RN: 147529-92-8
InChIKey: MNHSBTGIZPIGHA-BZDVOYDHSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H22-N4-O2-S4.2C2-H-F3-O2

Molecular Weight

  • 610.6396
 
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Names and Synonyms

Synonym

  • N,N'-Bis(thiazolidine-4 carboxylic acid)cystamine bis(trifluoroacetate)

Systematic Name

  • 4-Thiazolidinecarboxamide, N,N'-(dithiodi-2,1-ethanediyl)bis-, (R-(R*,R*))-, bis(trifluoroacetate)

Registry Numbers

CAS Registry Number

  • 147529-92-8

System Generated Number

  • 0147529928

Molecular Formulas

Molecular Formula

  • C12-H22-N4-O2-S4.2C2-H-F3-O2

Molecular Formula Fragments

  • C12-H22-N4-O2-S4
  • C2-H-F3-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C12H22N4O2S4.2C2HF3O2/c13-11(17)9-5-19-7-15(9)1-3-21-22-4-2-16-8-20-6-10(16)12(14)18;2*3-2(4,5)1(6)7/h9-10H,1-8H2,(H2,13,17)(H2,14,18);2*(H,6,7)/t9-,10-;;/m0../s1

InChIKey

MNHSBTGIZPIGHA-BZDVOYDHSA-N

Smiles

C1[C@H](N(CS1)CCSSCCN2CSC[C@H]2C(=O)N)C(=O)N.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 800mg/kg (800mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 27, Pg. 809, 1992.