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Substance Name: Isonicotinic acid, (5-bromo-3-phenyl-2-benzofuranylmethylene)hydrazide
RN: 72109-19-4
InChIKey: SNSBGOVABGMKMH-ZMOGYAJESA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H14-Br-N3-O2

Molecular Weight

  • 420.265
 
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Names and Synonyms

Synonyms

  • 2-Formyl-3-phenyl-5-bromobenzofuran nicotinoylhydrazone
  • 5-22-02-00267 (Beilstein Handbook Reference)
  • BRN 0445348

Systematic Name

  • Isonicotinic acid, (5-bromo-3-phenyl-2-benzofuranylmethylene)hydrazide

Registry Numbers

CAS Registry Number

  • 72109-19-4

System Generated Number

  • 0072109194

Structure Descriptors

InChI

1S/C21H14BrN3O2/c22-16-6-7-18-17(12-16)20(14-4-2-1-3-5-14)19(27-18)13-24-25-21(26)15-8-10-23-11-9-15/h1-13H,(H,25,26)/b24-13+

InChIKey

SNSBGOVABGMKMH-ZMOGYAJESA-N

Smiles

c1(c2c(ccc(c2)Br)oc1\C=N\NC(c1ccncc1)=O)c1ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 870mg/kg (870mg/kg) CARDIAC: ARRHYTHMIAS (INCLUDING CHANGES IN CONDUCTION) Pharmaceutical Chemistry Journal Vol. 13, Pg. 814, 1979.