3-[[2-[2,4-Bis(1,1-dimethylpropyl)phenoxy]acetyl]amino]-N-[4,5-dihydro-5-oxo-1-(2,4,6-trichlorophenyl)-1H-pyrazol-3-yl]benzamide

CAS Registry Number®

31188-91-7

CAS Name

3-[[2-[2,4-Bis(1,1-dimethylpropyl)phenoxy]acetyl]amino]-N-[4,5-dihydro-5-oxo-1-(2,4,6-trichlorophenyl)-1H-pyrazol-3-yl]benzamide

Molecular Formula

C34H37Cl3N4O4

Molecular Mass

672.04

Cite this Page

3-[[2-[2,4-Bis(1,1-dimethylpropyl)phenoxy]acetyl]amino]-N-[4,5-dihydro-5-oxo-1-(2,4,6-trichlorophenyl)-1H-pyrazol-3-yl]benzamide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=31188-91-7 (retrieved 2024-11-29) (CAS RN: 31188-91-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    138-139 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C34H37Cl3N4O4/c1-7-33(3,4)21-12-13-27(24(15-21)34(5,6)8-2)45-19-29(42)38-23-11-9-10-20(14-23)32(44)39-28-18-30(43)41(40-28)31-25(36)16-22(35)17-26(31)37/h9-17H,7-8,18-19H2,1-6H3,(H,38,42)(H,39,40,44)

InChIKey

InChIKey=QDIMMGOJTIUSOA-UHFFFAOYSA-N

SMILES

O=C1N(N=C(NC(=O)C2=CC(NC(COC3=C(C(CC)(C)C)C=C(C(CC)(C)C)C=C3)=O)=CC=C2)C1)C4=C(Cl)C=C(Cl)C=C4Cl

Canonical SMILES

O=C(NC1=NN(C(=O)C1)C=2C(Cl)=CC(Cl)=CC2Cl)C=3C=CC=C(C3)NC(=O)COC4=CC=C(C=C4C(C)(C)CC)C(C)(C)CC

Other Names for this Substance

  • Benzamide, 3-[[2-[2,4-bis(1,1-dimethylpropyl)phenoxy]acetyl]amino]-N-[4,5-dihydro-5-oxo-1-(2,4,6-trichlorophenyl)-1H-pyrazol-3-yl]-
  • Benzamide, 3-[[[2,4-bis(1,1-dimethylpropyl)phenoxy]acetyl]amino]-N-[4,5-dihydro-5-oxo-1-(2,4,6-trichlorophenyl)-1H-pyrazol-3-yl]-
  • Benzamide, m-[2-(2,4-di-tert-pentylphenoxy)acetamido]-N-[5-oxo-1-(2,4,6-trichlorophenyl)-2-pyrazolin-3-yl]-
  • Acetanilide, 2-(2,4-di-tert-pentylphenoxy)-3′-[[5-oxo-1-(2,4,6-trichlorophenyl)-2-pyrazolin-3-yl]carbamoyl]-
  • 3-[[2-[2,4-Bis(1,1-dimethylpropyl)phenoxy]acetyl]amino]-N-[4,5-dihydro-5-oxo-1-(2,4,6-trichlorophenyl)-1H-pyrazol-3-yl]benzamide

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Deleted or Replaced CAS Registry Numbers

124576-82-5, 32234-88-1, 93672-49-2

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