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Substance Name: Benzoic acid, p-((1,3-diphenyl-5-oxo-2-pyrazolin-4-ylidene)methylamino)-, ethyl ester
RN: 23711-43-5
InChIKey: HDKADHOVWUODBG-XLNRJJMWSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H21-N3-O3

Molecular Weight

  • 411.459
 
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Names and Synonyms

Synonyms

  • 5-25-15-00179 (Beilstein Handbook Reference)
  • BRN 0856037
  • Ethyl p-((1,3-diphenyl-5-oxo-2-pyrazolin-4-ylidene)methylamino)benzoate

Systematic Name

  • Benzoic acid, p-((1,3-diphenyl-5-oxo-2-pyrazolin-4-ylidene)methylamino)-, ethyl ester

Registry Numbers

CAS Registry Number

  • 23711-43-5

System Generated Number

  • 0023711435

Structure Descriptors

InChI

1S/C25H21N3O3/c1-2-31-25(30)19-13-15-20(16-14-19)26-17-22-23(18-9-5-3-6-10-18)27-28(24(22)29)21-11-7-4-8-12-21/h3-17,26H,2H2,1H3/b22-17-

InChIKey

HDKADHOVWUODBG-XLNRJJMWSA-N

Smiles

C=1(\C(C(=O)N(N1)c1ccccc1)=C\Nc1ccc(C(OCC)=O)cc1)c1ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 3gm/kg (3000mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 19, Pg. 1721, 1969.