<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">365474</id>
  <title nil="true"/>
  <common-name>N,n-dimethyl-3-morpholin-4-yl-3-sulfanylidenepropanethioamide</common-name>
  <description>N,n-dimethyl-3-morpholin-4-yl-3-sulfanylidenepropanethioamide is a chemical compound with the formula C9H16N2OS2. It has an average molecular weight of 232.40 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>214136</pubchem-id>
  <chemical-formula>C9H16N2OS2</chemical-formula>
  <weight>232.4</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">2026-09-01T16:05:03Z</created-at>
  <updated-at type="dateTime">2026-09-01T16:05:03Z</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>CN(C)C(=S)CC(=S)N1CCOCC1</moldb-smiles>
  <moldb-formula>C9H16N2OS2</moldb-formula>
  <moldb-inchi>InChI=1S/C9H16N2OS2/c1-10(2)8(13)7-9(14)11-3-5-12-6-4-11/h3-7H2,1-2H3</moldb-inchi>
  <moldb-inchikey>PANIXMPGCXCEJE-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">232.0704055</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>CHEM361367</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,n-dimethyl-3-morpholin-4-yl-3-sulfanylidenepropanethioamide</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>Oxazinanes</klass>
  <subklass>Morpholines</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0315427</sync-id>
  <structure-inchikey>PANIXMPGCXCEJE-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>100000000000000000800040020000000000000000000000000000000000000000000000000000000000000000000000000002000000000000000000001000001000000000000000000000000000000000800000000000000000004000000000000000010000000000000100004000040000020100020000000010000000000000000040000000000000000000000080100000000000000000000000000000000000000000000000000000000000040000000040000000008000000000000000000000000000000000000000000400000000000000000000000000000000000000000000000000000000000000000000000000000000000000104000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������(�������`�������(�������(�������`�������(�������(�������(�������`�������`������� ������`�������`�������������� ��(���������(��� �	�	
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	����������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T06:01:32Z</structure-indexed-at>
</compound>
