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Substance Name: Acetic acid, (4-((1,5-dihydro-3-methyl-5-oxo-4H-pyrazol-4-ylidene)methyl)phenoxy)-, ((3,4-dimethoxyphenyl)methylene)hydrazide
RN: 107044-97-3
InChIKey: CMRWRQQMANGUNC-QWMFIMKVSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H22-N4-O5

Molecular Weight

  • 422.4388
 
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Names and Synonyms

Synonym

  • BRN 5654521

Systematic Name

  • Acetic acid, (4-((1,5-dihydro-3-methyl-5-oxo-4H-pyrazol-4-ylidene)methyl)phenoxy)-, ((3,4-dimethoxyphenyl)methylene)hydrazide

Registry Numbers

CAS Registry Number

  • 107044-97-3

System Generated Number

  • 0107044973

Structure Descriptors

InChI

1S/C22H22N4O5/c1-14-18(22(28)26-24-14)10-15-4-7-17(8-5-15)31-13-21(27)25-23-12-16-6-9-19(29-2)20(11-16)30-3/h4-12H,13H2,1-3H3,(H,25,27)(H,26,28)/b18-10-,23-12+

InChIKey

CMRWRQQMANGUNC-QWMFIMKVSA-N

Smiles

CC\1=NNC(=O)/C1=C\c2ccc(cc2)OCC(=O)N/N=C/c3ccc(c(c3)OC)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1gm/kg (1000mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 25, Pg. 339, 1986.