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<compound>
  <id type="integer">77180</id>
  <title nil="true"/>
  <common-name>2,4(1H,3H)-Pyrimidinedione, dihydro-5,5-diethyl-6-thioxo-</common-name>
  <description>2,4(1H,3H)-Pyrimidinedione, dihydro-5,5-diethyl-6-thioxo- belongs to the pyrimidines and pyrimidine derivatives, a subclass of diazines within the organic compounds. It is classified as an organoheterocyclic compound with the formula C8H12N2O2S1. The compound has an average molecular weight of 200.26 g/mol.</description>
  <cas>6300-97-6</cas>
  <pubchem-id>3034182</pubchem-id>
  <chemical-formula>C8H12N2O2S1</chemical-formula>
  <weight>200.26</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">2026-04-04T08:31:46Z</created-at>
  <updated-at type="dateTime">2026-08-24T13:25:09Z</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>CCC1(CC)C(=O)NC(=O)NC1=S</moldb-smiles>
  <moldb-formula>C8H12N2O2S1</moldb-formula>
  <moldb-inchi>InChI=1S/C8H12N2O2S/c1-3-8(4-2)5(11)9-7(12)10-6(8)13/h3-4H2,1-2H3,(H2,9,10,11,12,13)</moldb-inchi>
  <moldb-inchikey>KUMCLYGZVRXJMG-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">200.26</moldb-average-mass>
  <moldb-mono-mass type="decimal">200.061948</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>1.5</logp>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id>2298689</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>CHEM073073</chemdb-id>
  <dsstox-id>DTXSID70212219</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00035248</susdat-id>
  <iupac>5,5-diethyl-6-sulfanylidene-1,3-diazinane-2,4-dione</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>Diazines</klass>
  <subklass>Pyrimidines and pyrimidine derivatives</subklass>
  <paper-count type="integer">0</paper-count>
  <sync-id>CED0129899</sync-id>
  <structure-inchikey>KUMCLYGZVRXJMG-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>800040000000000000000000000000000000800000000000000002000020040000000000000000000000000000000000000000000000000000000000000000000000000000000020000000000000004000000000000000000000000000004000000000000000000000000000000000000000000001000000000048008000000000200000000000000000000000000000000000001000000000000000000001000000080000000000000000000080000000000000020000000000000000000000000000000000000000000000040000000000000000000000000000000000000000000000000000000000000002000000000000000004</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
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  <structure-indexed-at type="dateTime">2026-09-19T04:24:58Z</structure-indexed-at>
</compound>
