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Substance Name: Acetamidine, 2,2'-dithiobis(N-cyclopentylmethyl-, dihydrochloride
RN: 40284-17-1
InChIKey: KFRSAMMHRXBCJH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H30-N4-S2.2Cl-H

Molecular Weight

  • 415.495
 
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Names and Synonyms

Synonym

  • 2,2'-Dithiobis(N-cyclopentylmethylacetamidine) dihydrochloride

Systematic Name

  • Acetamidine, 2,2'-dithiobis(N-cyclopentylmethyl-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 40284-17-1

System Generated Number

  • 0040284171

Molecular Formulas

Molecular Formula

  • C16-H30-N4-S2.2Cl-H

Molecular Formula Fragments

  • C16-H30-N4-S2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C16H30N4S2.2ClH/c17-15(19-9-13-5-1-2-6-13)11-21-22-12-16(18)20-10-14-7-3-4-8-14;;/h13-14H,1-12H2,(H2,17,19)(H2,18,20);2*1H

InChIKey

KFRSAMMHRXBCJH-UHFFFAOYSA-N

Smiles

C1(CNC(CSSCC(NCC2CCCC2)=[NH+])=[NH+])CCCC1.[ClH-].[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 60mg/kg (60mg/kg)   Journal of Medicinal Chemistry. Vol. 15, Pg. 1313, 1972.
mouse LD50 oral 63mg/kg (63mg/kg)   Journal of Medicinal Chemistry. Vol. 15, Pg. 1313, 1972.