Pyrinuron

CAS Registry Number®

53558-25-1

CAS Name

Pyrinuron

Molecular Formula

C13H12N4O3

Molecular Mass

272.26

Cite this Page

Pyrinuron.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=53558-25-1 (retrieved 2024-11-21) (CAS RN: 53558-25-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    223-225 °C (decomp)

Source(s)

  • (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)

Other Names and Identifiers

InChI

InChI=1S/C13H12N4O3/c18-13(15-9-10-2-1-7-14-8-10)16-11-3-5-12(6-4-11)17(19)20/h1-8H,9H2,(H2,15,16,18)

InChIKey

InChIKey=CLKZWXHKFXZIMA-UHFFFAOYSA-N

SMILES

N(C(NCC=1C=CC=NC1)=O)C2=CC=C(N(=O)=O)C=C2

Canonical SMILES

O=C(NC1=CC=C(C=C1)N(=O)=O)NCC=2C=NC=CC2

Other Names for this Substance

  • Urea, N-(4-nitrophenyl)-N′-(3-pyridinylmethyl)-
  • N-(4-Nitrophenyl)-N′-(3-pyridinylmethyl)urea
  • RH 787
  • 1-(4-Nitrophenyl)-3-(3-pyridylmethyl)urea
  • Vacor

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Deleted or Replaced CAS Registry Numbers

64060-28-2

CAS INSIGHTSTM
Targeted protein degrader structure, illustration