363903 <common-name>8-nitro-2-sulfanylidene-1,3-benzoxazin-4-one</common-name> <description>8-nitro-2-sulfanylidene-1,3-benzoxazin-4-one is a chemical compound with the formula C8H4N2O4S. It has an average molecular weight of 224.20 g/mol.</description> <cas>23611-69-0</cas> <pubchem-id>3038273</pubchem-id> <chemical-formula>C8H4N2O4S</chemical-formula> <weight>224.2</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">2026-09-01T13:36:52Z</created-at> <updated-at type="dateTime">2026-09-01T13:36:52Z</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>C1=CC2=C(C(=C1)[N+](=O)[O-])OC(=S)NC2=O</moldb-smiles> <moldb-formula>C8H4N2O4S</moldb-formula> <moldb-inchi>InChI=1S/C8H4N2O4S/c11-7-4-2-1-3-5(10(12)13)6(4)14-8(15)9-7/h1-3H,(H,9,11,15)</moldb-inchi> <moldb-inchikey>PMKOYZPSGYYYGN-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">223.9891778</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>1.4</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>CHEM359796</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>8-nitro-2-sulfanylidene-1,3-benzoxazin-4-one</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>Benzoxazines</klass> <subklass nil="true"/> <paper-count type="integer" nil="true"/> <sync-id>CED0313924</sync-id> <structure-inchikey>PMKOYZPSGYYYGN-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000000040000000800000000000000000000000000000000000020000100002000000000000000000000000000000000000000000000000000000000000000000000000020800000000000001800000002400000000000000000000200000010000000000000000000000004000000000000000001000000000000800000200000000000000000001000000000000000000800000000004000000000040000080000000000000000000000000000000000000000000000040000000800000008000000000000000000140000004200000000000000000000000000000040000000000000000000001000000000000000200000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAPAAAAEAAAAIABBkBoAAAAAwMBBkBoAAAA AwMBBkAoAAAAAwQGQCgAAAADBAZAKAAAAAMEBkBoAAAAAwMBByAqAAAAAQME CAAoAAAAAwIIICoAAAD/AwEIQCgAAAADAgZAKAAAAAMEEAAoAAAAAwIHQDgA AAADAQMGQCgAAAADBAgAKAAAAAMCCwABaAwBAmgMAgNoDAMEaAwEBWgMBAYg BgcoAgYIIAMJaAwJCmgMCgsoAgoMaAwMDWgMDQ4oAgUAaAwNAmgMQgIAAAAG AAUEAwIBBgkKDA0CAxcEAAAAAAAAABY= </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T06:00:23Z</structure-indexed-at> </compound>