<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">365576</id>
  <title nil="true"/>
  <common-name>Methyl (1z)-n-[methyl(morpholin-4-ylsulfanyl)carbamoyl]oxyethanimidothioate</common-name>
  <description>Methyl (1z)-n-[methyl(morpholin-4-ylsulfanyl)carbamoyl]oxyethanimidothioate is a compound with the formula C9H17N3O3S2. It has an average molecular weight of 279.40 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>6507093</pubchem-id>
  <chemical-formula>C9H17N3O3S2</chemical-formula>
  <weight>279.4</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">2026-09-01T16:15:34Z</created-at>
  <updated-at type="dateTime">2026-09-01T16:15:34Z</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>CC(=NOC(=O)N(C)SN1CCOCC1)SC</moldb-smiles>
  <moldb-formula>C9H17N3O3S2</moldb-formula>
  <moldb-inchi>InChI=1S/C9H17N3O3S2/c1-8(16-3)10-15-9(13)11(2)17-12-4-6-14-7-5-12/h4-7H2,1-3H3/b10-8-</moldb-inchi>
  <moldb-inchikey>SISHVWPXUJZTSV-NTMALXAHSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">279.0711338</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>1.3</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>CHEM361469</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>Methyl (1z)-n-[methyl(morpholin-4-ylsulfanyl)carbamoyl]oxyethanimidothioate</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>CED0315526</sync-id>
  <structure-inchikey>SISHVWPXUJZTSV-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>800000800000000000000000000000000000000000000000000000000000000000000200000000100000000000000000000001001000000000000000001000000000020800000000100000004000000000000000000210000000000004000004000000000020100020000000010000000400000000040000400000000000000000000100c00000000000000000000010000000000000000000000000000000000040000000048000000008000000000000000000000100002000000000000800000000000000000000000000000000000000000200000000000000001000000000400000000000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������(�������(�������(�������(�������(�������(�������`������� ������ ������`�������`������� ������`�������`������� ������`�����������(��� �� ��(��� �������	�	
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  <structure-indexed-at type="dateTime">2026-09-19T06:01:38Z</structure-indexed-at>
</compound>
