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Substance Name: 3-((2-(2,4-Bis(tert-pentyl)phenoxy)butyryl)amino)-N-(4,5-dihydro-5-oxo-1-(2,4,6-trichlorophenyl)-1H-pyrazol-3-yl)benzamide
RN: 31598-52-4
InChIKey: YRDPBPLUAPBDQV-UHFFFAOYSA-N

Molecular Formula

  • C36-H41-Cl3-N4-O4

Molecular Weight

  • 700.1029
 
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Names and Synonyms

Synonym

  • EINECS 250-720-6

Systematic Name

  • 3-((2-(2,4-Bis(tert-pentyl)phenoxy)butyryl)amino)-N-(4,5-dihydro-5-oxo-1-(2,4,6-trichlorophenyl)-1H-pyrazol-3-yl)benzamide

Registry Numbers

CAS Registry Number

  • 31598-52-4

System Generated Number

  • 0031598524

Structure Descriptors

InChI

1S/C36H41Cl3N4O4/c1-8-28(47-29-15-14-22(35(4,5)9-2)17-25(29)36(6,7)10-3)34(46)40-24-13-11-12-21(16-24)33(45)41-30-20-31(44)43(42-30)32-26(38)18-23(37)19-27(32)39/h11-19,28H,8-10,20H2,1-7H3,(H,40,46)(H,41,42,45)

InChIKey

YRDPBPLUAPBDQV-UHFFFAOYSA-N

Smiles

CCC(C(=O)Nc1cccc(c1)C(=O)NC2=NN(C(=O)C2)c3c(cc(cc3Cl)Cl)Cl)Oc4ccc(cc4C(C)(C)CC)C(C)(C)CC