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Substance Name: 1H-Pyrazole-3-carboxylic acid, 5-phenyl-, 2-(1,2-dioxo-3-(triphenylphosphoranylidene)propyl)hydrazide
RN: 149990-87-4
InChIKey: UQIASEDWZNZTTN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C31-H25-N4-O3-P

Molecular Weight

  • 532.5375
 
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Names and Synonyms

Synonym

  • Triphenylphosphoranylidenepyruvoyl hydrazide of 5-phenyl-3-pyrazolecarboxylic acid

Systematic Name

  • 1H-Pyrazole-3-carboxylic acid, 5-phenyl-, 2-(1,2-dioxo-3-(triphenylphosphoranylidene)propyl)hydrazide

Registry Numbers

CAS Registry Number

  • 149990-87-4

System Generated Number

  • 0149990874

Structure Descriptors

InChI

1S/C31H25N4O3P/c36-29(31(38)35-34-30(37)28-21-27(32-33-28)23-13-5-1-6-14-23)22-39(24-15-7-2-8-16-24,25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-22H,(H,32,33)(H,34,37)(H,35,38)

InChIKey

UQIASEDWZNZTTN-UHFFFAOYSA-N

Smiles

c1ccc(cc1)c2cc(n[nH]2)C(=O)NNC(=O)C(=O)C=P(c3ccccc3)(c4ccccc4)c5ccccc5

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 500mg/kg (500mg/kg)   Pharmaceutical Chemistry Journal Vol. 26, Pg. 575, 1992.
mouse LD oral > 500mg/kg (500mg/kg)   Pharmaceutical Chemistry Journal Vol. 26, Pg. 575, 1992.