<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">325300</id>
  <title nil="true"/>
  <common-name>N-(1-benzoyl-5-chloro-2-hydroxyindol-3-yl)iminobenzenesulfonamide</common-name>
  <description nil="true"/>
  <cas nil="true"/>
  <pubchem-id>135537734</pubchem-id>
  <chemical-formula>C21H14ClN3O4S</chemical-formula>
  <weight>439.9</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">2026-08-30T03:00:04Z</created-at>
  <updated-at type="dateTime">2026-08-30T03:00:04Z</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=C(C=C1)C(=O)N2C3=C(C=C(C=C3)Cl)C(=C2O)N=NS(=O)(=O)C4=CC=CC=C4</moldb-smiles>
  <moldb-formula>C21H14ClN3O4S</moldb-formula>
  <moldb-inchi>InChI=1S/C21H14ClN3O4S/c22-15-11-12-18-17(13-15)19(23-24-30(28,29)16-9-5-2-6-10-16)21(27)25(18)20(26)14-7-3-1-4-8-14/h1-13,27H</moldb-inchi>
  <moldb-inchikey>FJTYJBAQKPHADQ-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">439.0393548</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>6</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>CHEM321193</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>N-(1-benzoyl-5-chloro-2-hydroxyindol-3-yl)iminobenzenesulfonamide</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>Indoles and derivatives</klass>
  <subklass>Benzoylindoles</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0275940</sync-id>
  <structure-inchikey>FJTYJBAQKPHADQ-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>400000000000000000000000000000400000000000084020100000000000000000001000000020100000004200000000000000000000000000000000000000000400100080000000000000020000000000000000004000000000000000000110080000000000000100000000000001100000000000000400100000000000000008000c00000000000000000000000000100000000000008000800200000000000000000040000084000000000000000000002080000008100000000000000000000002000000000000000400010000000000000000200000000000000000000000000000040000000000400000000000000004000000004000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ��������������������!���€��@h�������@h�������@h�������@(������@h�������@h��������(�������(������@(������@(������@(������@h�������@(������@h�������@h�������� �����@(������@(�������h��������(�������(������� ������(�������(������@(������@h�������@h�������@h�������@h�������@h���������h���h���h���h���h��� ��(��� �	h�	
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	������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:29:13Z</structure-indexed-at>
</compound>
