<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">364194</id>
  <title nil="true"/>
  <common-name>4-(1h-1,2,4-triazol-5-yl)benzenesulfonamide</common-name>
  <description>4-(1h-1,2,4-triazol-5-yl)benzenesulfonamide is a chemical compound with the formula C8H8N4O2S. It has an average molecular weight of 224.24 g/mol.</description>
  <cas>4922-53-6</cas>
  <pubchem-id>199762</pubchem-id>
  <chemical-formula>C8H8N4O2S</chemical-formula>
  <weight>224.24</weight>
  <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">2026-09-01T14:02:40Z</created-at>
  <updated-at type="dateTime">2026-09-01T14:02:40Z</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>C1=CC(=CC=C1C2=NC=NN2)S(=O)(=O)N</moldb-smiles>
  <moldb-formula>C8H8N4O2S</moldb-formula>
  <moldb-inchi>InChI=1S/C8H8N4O2S/c9-15(13,14)7-3-1-6(2-4-7)8-10-5-11-12-8/h1-5H,(H2,9,13,14)(H,10,11,12)</moldb-inchi>
  <moldb-inchikey>FQAHYLJIQSNCSE-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">224.0367967</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>0.2</logp>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id nil="true"/>
  <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>CHEM360087</chemdb-id>
  <dsstox-id nil="true"/>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id nil="true"/>
  <iupac>4-(1h-1,2,4-triazol-5-yl)benzenesulfonamide</iupac>
  <moldb-polar-surface-area nil="true"/>
  <moldb-refractivity nil="true"/>
  <moldb-polarizability nil="true"/>
  <moldb-rotatable-bond-count nil="true"/>
  <moldb-acceptor-count nil="true"/>
  <moldb-donor-count nil="true"/>
  <moldb-pka-strongest-acidic nil="true"/>
  <moldb-pka-strongest-basic nil="true"/>
  <moldb-physiological-charge nil="true"/>
  <moldb-number-of-rings nil="true"/>
  <moldb-alogps-logp nil="true"/>
  <moldb-alogps-logs nil="true"/>
  <moldb-alogps-solubility nil="true"/>
  <kingdom>Organic compounds</kingdom>
  <superklass>Organoheterocyclic compounds</superklass>
  <klass>Azoles</klass>
  <subklass>Triazoles</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0314203</sync-id>
  <structure-inchikey>FQAHYLJIQSNCSE-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>20000000000002000000000000000000000000000000000000000000000001000000020000002040000000000000000000000000400000000000000000000000000000400000000020000000000000001000000000000000000000000000004000000000000000800000000000000000000000000000000000000000000000000000200000000000801000000400000000000000000000000000000000000000000000080000000000000000080000080040000000000000000000000000000140000000000000000100002000000000200200000000000000000000000000000040000000000000000000000100000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
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</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T06:00:37Z</structure-indexed-at>
</compound>
