<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">44456</id>
  <title nil="true"/>
  <common-name>Isopyrazam</common-name>
  <description nil="true"/>
  <cas>881685-58-1</cas>
  <pubchem-id>25271089</pubchem-id>
  <chemical-formula>C20H23F2N3O</chemical-formula>
  <weight nil="true"/>
  <appearance nil="true"/>
  <melting-point nil="true"/>
  <boiling-point nil="true"/>
  <density nil="true"/>
  <solubility nil="true"/>
  <specific-gravity nil="true"/>
  <flash-point nil="true"/>
  <vapour-pressure nil="true"/>
  <route-of-exposure nil="true"/>
  <target nil="true"/>
  <mechanism-of-toxicity nil="true"/>
  <metabolism nil="true"/>
  <toxicity nil="true"/>
  <lethaldose nil="true"/>
  <carcinogenicity nil="true"/>
  <use-source nil="true"/>
  <min-risk-level nil="true"/>
  <health-effects nil="true"/>
  <symptoms nil="true"/>
  <treatment nil="true"/>
  <created-at type="dateTime">2016-06-03T10:50:31Z</created-at>
  <updated-at type="dateTime">2026-04-04T18:06:07Z</updated-at>
  <interacting-proteins nil="true"/>
  <wikipedia nil="true"/>
  <uniprot-id nil="true"/>
  <kegg-compound-id nil="true"/>
  <omim-id nil="true"/>
  <chebi-id nil="true"/>
  <biocyc-id nil="true"/>
  <ctd-id nil="true"/>
  <stitch-id nil="true"/>
  <drugbank-id nil="true"/>
  <pdb-id nil="true"/>
  <actor-id nil="true"/>
  <organism nil="true"/>
  <export type="boolean">true</export>
  <metabolizing-proteins nil="true"/>
  <transporting-proteins nil="true"/>
  <moldb-smiles>CC(C)C1C2CCC1C1=C2C=CC=C1N=C(O)C1=CN(C)N=C1C(F)F</moldb-smiles>
  <moldb-formula>C20H23F2N3O</moldb-formula>
  <moldb-inchi>InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)</moldb-inchi>
  <moldb-inchikey>XTDZGXBTXBEZDN-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">359.421</moldb-average-mass>
  <moldb-mono-mass type="decimal">359.180918699</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp nil="true"/>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id>23078568</chemspider-id>
  <structure-image-file-name nil="true"/>
  <structure-image-content-type nil="true"/>
  <structure-image-file-size type="integer" nil="true"/>
  <structure-image-updated-at type="dateTime" nil="true"/>
  <biodb-id nil="true"/>
  <synthesis-reference nil="true"/>
  <structure-image-caption nil="true"/>
  <chemdb-id>CHEM043351</chemdb-id>
  <dsstox-id>DTXSID7058208</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin>University of Hertfordshire (2013) The Pesticide Properties DataBase (PPDB) developed by the Agriculture &amp; Environment Research Unit (AERU), University of Hertfordshire, 2006-2013</stoff-ident-origin>
  <stoff-ident-id>SI00002242</stoff-ident-id>
  <susdat-id>NS00040576</susdat-id>
  <iupac>3-(difluoromethyl)-1-methyl-N-[11-(propan-2-yl)tricyclo[6.2.1.0^{2,7}]undeca-2(7),3,5-trien-3-yl]-1H-pyrazole-4-carboximidic acid</iupac>
</compound>
