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Substance Name: Propionamide, N,N'-(dithiodiethylene)bis(2-amino-, L-, bis(trifluoroacetate)
RN: 97313-95-6
InChIKey: WKQHHBKGRLWVAY-FOMWZSOGSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H24-F6-N4-O6-S2

Molecular Weight

  • 522.4856
 
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Names and Synonyms

Synonym

  • L-N,N'-(Dithiodiethylene)bis(2-aminopropionamide) bis(trifluoroacetate)

Systematic Name

  • Propionamide, N,N'-(dithiodiethylene)bis(2-amino-, L-, bis(trifluoroacetate)

Registry Numbers

CAS Registry Number

  • 97313-95-6

System Generated Number

  • 0097313956

Structure Descriptors

InChI

1S/C10H22N4O2S2.2C2HF3O2/c1-7(11)9(15)13-3-5-17-18-6-4-14-10(16)8(2)12;2*3-2(4,5)1(6)7/h7-8H,3-6,11-12H2,1-2H3,(H,13,15)(H,14,16);2*(H,6,7)/t7-,8-;;/m0../s1

InChIKey

WKQHHBKGRLWVAY-FOMWZSOGSA-N

Smiles

S(SCCNC(=O)[C@H](C)N)CCNC(=O)[C@H](C)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 1200mg/kg (1200mg/kg)   Journal of Medicinal Chemistry. Vol. 29, Pg. 2217, 1986.