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Substance Name: 1H-Benzimidazole-5-methanamine, 4,5,6,7-tetrahydro-N-cyclopentyl-1-ethyl-, (E)-2-butenedioate (2:3)
RN: 96224-23-6
InChIKey: VMJSMKHFIVOBOQ-WLHGVMLRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H25-N3.3/2C4-H4-O4

Molecular Weight

  • 363.455
 
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Names and Synonyms

Synonyms

  • 4,5,6,7-Tetrahydro-5-((cyclopentylamino)methyl)-1-ethylbenzimidazole fumarate (2:3)
  • Benzimidazole, 4,5,6,7-tetrahydro-5-((cyclopentylamino)methyl)-1-ethyl-, fumarate (2:3)

Systematic Name

  • 1H-Benzimidazole-5-methanamine, 4,5,6,7-tetrahydro-N-cyclopentyl-1-ethyl-, (E)-2-butenedioate (2:3)

Registry Numbers

CAS Registry Number

  • 96224-23-6

System Generated Number

  • 0096224236

Molecular Formulas

Molecular Formula

  • C15-H25-N3.3/2C4-H4-O4

Molecular Formula Fragments

  • C15-H25-N3
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C15H25N3.C4H4O4/c1-3-18-11-16-14-10-13(8-9-15(14)18)17(2)12-6-4-5-7-12;5-3(6)1-2-4(7)8/h11-13H,3-10H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+

InChIKey

VMJSMKHFIVOBOQ-WLHGVMLRSA-N

Smiles

c12c(n(cn2)CC)CC[C@@H](C1)[N@@](C)C1CCCC1.C(=C\C(O)=O)\C(O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 400mg/kg (400mg/kg)   Farmaco, Edizione Scientifica. Vol. 40, Pg. 818, 1985.