<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">358584</id>
  <title nil="true"/>
  <common-name>5-(2-hydroxyethylamino)-3h-1,3,4-thiadiazole-2-thione</common-name>
  <description>5-(2-hydroxyethylamino)-3h-1,3,4-thiadiazole-2-thione is a chemical compound with the formula C4H7N3OS2. It has an average molecular weight of 177.30 g/mol.</description>
  <cas>63503-52-6</cas>
  <pubchem-id>3033225</pubchem-id>
  <chemical-formula>C4H7N3OS2</chemical-formula>
  <weight>177.3</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">2026-09-01T06:21:18Z</created-at>
  <updated-at type="dateTime">2026-09-01T06:21:18Z</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>C(CO)NC1=NNC(=S)S1</moldb-smiles>
  <moldb-formula>C4H7N3OS2</moldb-formula>
  <moldb-inchi>InChI=1S/C4H7N3OS2/c8-2-1-5-3-6-7-4(9)10-3/h8H,1-2H2,(H,5,6)(H,7,9)</moldb-inchi>
  <moldb-inchikey>NJNXWLQIDWTHFP-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">177.0030542</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>0.1</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>CHEM354477</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>5-(2-hydroxyethylamino)-3h-1,3,4-thiadiazole-2-thione</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>Thiadiazoles</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0308813</sync-id>
  <structure-inchikey>NJNXWLQIDWTHFP-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>20800040000000000000002000000000000002002000000000000000000000000000000000002040000000000000800000004020000000000000000000000000000000000000000000001010000000000010000000000001000000010000000020000000000000000000000000000000000000000000000000000000000000000000220000000080000000000000000000000000000000000000000000000000000000080000000080000000000010000000000000000000000000000000000000000000000000000000200000040000000000000000000000000000000000000000000000000000000000000000000000080000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ����������������
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  <structure-indexed-at type="dateTime">2026-09-19T05:56:13Z</structure-indexed-at>
</compound>
