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Substance Name: p-Toluamide, N-(2-(1-benzimidazolyl)ethyl)-, monopicrate
RN: 22261-49-0
InChIKey: MLAPEMPFYBJRDY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H17-N3-O.C6-H3-N3-O7

Molecular Weight

  • 508.445
 
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Names and Synonyms

Synonym

  • N-(2-(1-Benzimidazolyl)ethyl)-p-toluamide picrate

Systematic Name

  • p-Toluamide, N-(2-(1-benzimidazolyl)ethyl)-, monopicrate

Registry Numbers

CAS Registry Number

  • 22261-49-0

System Generated Number

  • 0022261490

Molecular Formulas

Molecular Formula

  • C17-H17-N3-O.C6-H3-N3-O7

Molecular Formula Fragments

  • C17-H17-N3-O
  • C6-H3-N3-O7
  • COMPONENT

Structure Descriptors

InChI

1S/C17H17N3O.C6H3N3O7/c1-13-6-8-14(9-7-13)17(21)18-10-11-20-12-19-15-4-2-3-5-16(15)20;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h2-9,12H,10-11H2,1H3,(H,18,21);1-2,10H

InChIKey

MLAPEMPFYBJRDY-UHFFFAOYSA-N

Smiles

c1(C(=O)NCCn2c3c(nc2)cccc3)ccc(C)cc1.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 250mg/kg (250mg/kg) BRAIN AND COVERINGS: RECORDINGS FROM SPECIFIC AREAS OF CNS

BEHAVIORAL: MUSCLE WEAKNESS
Pharmaceutical Chemistry Journal Vol. 2, Pg. 492, 1968.