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Substance Name: Benzimidazole, 2-(p-cumenylthio)-1-(2-(diethylamino)ethyl)-, dipicrate
RN: 4929-62-8
InChIKey: YGEUURILQIXIJM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H29-N3-S.2C6-H3-N3-O7

Molecular Weight

  • 825.766
 
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Names and Synonyms

Synonym

  • 2-(p-Cumenylthio)-1-(2-(diethylamino)ethyl)benzimidazole dipicrate

Systematic Name

  • Benzimidazole, 2-(p-cumenylthio)-1-(2-(diethylamino)ethyl)-, dipicrate

Registry Numbers

CAS Registry Number

  • 4929-62-8

System Generated Number

  • 0004929628

Molecular Formulas

Molecular Formula

  • C22-H29-N3-S.2C6-H3-N3-O7

Molecular Formula Fragments

  • C22-H29-N3-S
  • C6-H3-N3-O7
  • COMPONENT

Structure Descriptors

InChI

1S/C22H29N3S.2C6H3N3O7/c1-5-24(6-2)15-16-25-21-10-8-7-9-20(21)23-22(25)26-19-13-11-18(12-14-19)17(3)4;2*10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h7-14,17H,5-6,15-16H2,1-4H3;2*1-2,10H

InChIKey

YGEUURILQIXIJM-UHFFFAOYSA-N

Smiles

c1(nc2c(n1CCN(CC)CC)cccc2)Sc1ccc(cc1)C(C)C.Oc1c([N+]([O-])=O)cc([N+]([O-])=O)cc1[N+]([O-])=O.Oc1c([N+]([O-])=O)cc([N+]([O-])=O)cc1[N+]([O-])=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 205mg/kg (205mg/kg) BEHAVIORAL: ANALGESIA Yakugaku Zasshi. Journal of Pharmacy. Vol. 85, Pg. 962, 1965.