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Substance Name: Benzoic acid, 4-(4,5-dihydro-4-(1H-indol-3-ylmethylene)-5-oxo-2-phenyl-1H-imidazol-1-yl)-, (((4-chlorophenyl)azo)(3,4-dimethoxyphenyl)methylene)hydrazide
RN: 134248-61-6
InChIKey: RJYKLHJNYSWUDP-WYFHAQILSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C40-H30-Cl-N7-O4

Molecular Weight

  • 708.175
 
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Names and Synonyms

Synonym

  • BRN 4777543

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 134248-61-6

System Generated Number

  • 0134248616

Structure Descriptors

InChI

1S/C40H30ClN7O4/c1-51-35-21-14-27(23-36(35)52-2)37(45-44-30-17-15-29(41)16-18-30)46-47-39(49)26-12-19-31(20-13-26)48-38(25-8-4-3-5-9-25)43-34(40(48)50)22-28-24-42-33-11-7-6-10-32(28)33/h3-24,42H,1-2H3,(H,47,49)/b34-22+,45-44+,46-37-

InChIKey

RJYKLHJNYSWUDP-WYFHAQILSA-N

Smiles

COc1ccc(cc1OC)/C(=N/NC(=O)c2ccc(cc2)N3C(=N/C(=C/c4c[nH]c5c4cccc5)/C3=O)c6ccccc6)/N=N/c7ccc(cc7)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 600mg/kg (600mg/kg)   Journal of the Indian Chemical Society. Vol. 67, Pg. 748, 1990.