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Substance Name: 1H-Imidazolium, 3-(7-chloro-2,3-dihydro-1-methyl-5-phenyl-1H-1,4-benzodiazepin-3-yl)-1-methyl-, chloride
RN: 53072-49-4
InChIKey: AZRRQLXMFVYGTD-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H18-Cl-N4-O.Cl

Molecular Weight

  • 401.2952
 
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Names and Synonyms

  • 1H-Imidazolium, 3-(7-chloro-2,3-dihydro-1-methyl-5-phenyl-1H-1,4-benzodiazepin-3-yl)-1-methyl-, chloride

Registry Numbers

CAS Registry Number

  • 53072-49-4

System Generated Number

  • 0053072494

Molecular Formulas

Molecular Formula

  • C20-H18-Cl-N4-O.Cl

Molecular Formula Fragments

  • C20-H18-Cl-N4-O
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C20H18ClN4O.ClH/c1-23-10-11-25(13-23)19-20(26)24(2)17-9-8-15(21)12-16(17)18(22-19)14-6-4-3-5-7-14;/h3-13,19H,1-2H3;1H/q+1;/p-1

InChIKey

AZRRQLXMFVYGTD-UHFFFAOYSA-M

Smiles

C[n+]1ccn(c1)C2C(=O)N(c3ccc(cc3C(=N2)c4ccccc4)Cl)C.[Cl-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 oral 1100ug/kg (1.1mg/kg)   Journal of Medicinal Chemistry. Vol. 17, Pg. 766, 1974.