<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">65703</id>
  <title nil="true"/>
  <common-name>2-[(5-Amino-1,3,4-thiadiazol-2-yl)thio]-N-(1,3-benzodioxol-5-yl)acetamide</common-name>
  <description>2-[(5-Amino-1,3,4-thiadiazol-2-yl)thio]-N-(1,3-benzodioxol-5-yl)acetamide belongs to the benzodioxoles, a class of organoheterocyclic compounds within the organic compounds. This compound has the chemical formula C11H10N4O3S2 and an average molecular weight of 310.35 g/mol.</description>
  <cas>301335-14-8</cas>
  <pubchem-id>1873398</pubchem-id>
  <chemical-formula>C11H10N4O3S2</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">2026-04-03T05:03:26Z</created-at>
  <updated-at type="dateTime">2026-04-03T05:03:26Z</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>NC1=NN=C(SCC(=O)NC2=CC3=C(OCO3)C=C2)S1</moldb-smiles>
  <moldb-formula>C11H10N4O3S2</moldb-formula>
  <moldb-inchi>InChI=1S/C11H10N4O3S2/c12-10-14-15-11(20-10)19-4-9(16)13-6-1-2-7-8(3-6)18-5-17-7/h1-3H,4-5H2,(H2,12,14)(H,13,16)</moldb-inchi>
  <moldb-inchikey>OJEYIDDDKFLBSM-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">310.35</moldb-average-mass>
  <moldb-mono-mass type="decimal">310.019432</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp nil="true"/>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id>1449215</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>CHEM061596</chemdb-id>
  <dsstox-id>DTXSID30365432</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00018257</susdat-id>
  <iupac>2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(1,3-benzodioxol-5-yl)acetamide</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>Benzodioxoles</klass>
  <subklass nil="true"/>
  <paper-count type="integer">0</paper-count>
  <sync-id>CED0150363</sync-id>
  <structure-inchikey>OJEYIDDDKFLBSM-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>4000000000800020000801000000002000008100000000000000000000000000000000000004000000002000000000000000400000000000000000000000000000000000000000000000000020800010000000000000002000000000000004010000000010000000100000040000020000000000000000010100000010000000000000000000001000000080081000000000000000000000008000000000000000000004000000080002000200000000014000000000002000000000000000000000000000000000010000000000000000000000000200000000000080008000000000010040000000400400000000010000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���h�������@(������@(������@(������@(������� ������`�������(�������(�������h�������@(������@h�������@(������@(�������(�������`�������(������@h�������@h�������@(�������� ��h���h���h������������(��	 	
 
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  <structure-indexed-at type="dateTime">2026-09-19T04:16:37Z</structure-indexed-at>
</compound>
