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Substance Name: Benzoic acid, 4-(4,5-dihydro-2-methyl-5-oxo-4-((2-phenyl-1H-indol-3-yl)methylene)-1H-imidazol-1-yl)-, ((3,4-dimethoxyphenyl)((2-methylphenyl)azo)methylene)hydrazide
RN: 134248-66-1
InChIKey: REPOBTWVWNNBGW-QCEPDKSLSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C42-H35-N7-O4

Molecular Weight

  • 701.7835
 
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Names and Synonyms

Synonym

  • BRN 4777846

Systematic Name

  • Benzoic acid, 4-(4,5-dihydro-2-methyl-5-oxo-4-((2-phenyl-1H-indol-3-yl)methylene)-1H-imidazol-1-yl)-, ((3,4-dimethoxyphenyl)((2-methylphenyl)azo)methylene)hydrazide

Registry Numbers

CAS Registry Number

  • 134248-66-1

System Generated Number

  • 0134248661

Structure Descriptors

InChI

1S/C42H35N7O4/c1-26-12-8-10-16-34(26)45-46-40(30-20-23-37(52-3)38(24-30)53-4)47-48-41(50)29-18-21-31(22-19-29)49-27(2)43-36(42(49)51)25-33-32-15-9-11-17-35(32)44-39(33)28-13-6-5-7-14-28/h5-25,44H,1-4H3,(H,48,50)/b36-25-,46-45+,47-40+

InChIKey

REPOBTWVWNNBGW-QCEPDKSLSA-N

Smiles

Cc1ccccc1/N=N/C(=N/NC(=O)c2ccc(cc2)N3C(=N/C(=C\c4c5ccccc5[nH]c4c6ccccc6)/C3=O)C)/c7ccc(c(c7)OC)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1200mg/kg (1200mg/kg)   Journal of the Indian Chemical Society. Vol. 67, Pg. 748, 1990.