281598 <common-name>5-ethyl-5-(3-methylbut-2-enyl)-2-sulfanylidene-1,3-diazinane-4,6-dione</common-name> <description>5-ethyl-5-(3-methylbut-2-enyl)-2-sulfanylidene-1,3-diazinane-4,6-dione belongs to the pyrimidines and pyrimidine derivatives, a subclass of diazines within the organic compounds. It is an organoheterocyclic compound with the formula C11H16N2O2S and an average molecular weight of 240.32 g/mol.</description> <cas>66968-74-9</cas> <pubchem-id>3033382</pubchem-id> <chemical-formula>C11H16N2O2S</chemical-formula> <weight>240.32</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">2026-08-27T16:56:08Z</created-at> <updated-at type="dateTime">2026-08-27T16:56:08Z</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(C(=O)NC(=S)NC1=O)CC=C(C)C</moldb-smiles> <moldb-formula>C11H16N2O2S</moldb-formula> <moldb-inchi>InChI=1S/C11H16N2O2S/c1-4-11(6-5-7(2)3)8(14)12-10(16)13-9(11)15/h5H,4,6H2,1-3H3,(H2,12,13,14,15,16)</moldb-inchi> <moldb-inchikey>APXKKHKGOFZXKH-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">240.0932489</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>2.4</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>CHEM277491</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-ethyl-5-(3-methylbut-2-enyl)-2-sulfanylidene-1,3-diazinane-4,6-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" nil="true"/> <sync-id>CED0233557</sync-id> <structure-inchikey>APXKKHKGOFZXKH-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>200000000000800040000000000000000000000000000000800000000000000002000020040000000000000000000000000000000000000100000000000000000000000000000002000000000020000000000200004000000000000000000000010000000000000000000000000000000000000000000000020001400000000048000000000000200000000000000000000000000000000000400000000000000000000001000000080000000000000000010000000000000000000000000400000200000000000000040000000000000000040000000000000000000000000000000000000000000000000000000000000000200000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAQAAAAEAAAAIABBgBgAAAAAQMGAGAAAAAC AgYAIAAAAAQGACgAAAADBAgAKAAAAAMCBwBoAAAAAwIBBgAoAAAAAwQQACgA AAADAgcAaAAAAAMCAQYAKAAAAAMECAAoAAAAAwIGAGAAAAACAgYAaAAAAAMD AQYAKAAAAAMEBgBgAAAAAQMGAGAAAAABAwsAAQABAgACAwADBCgCAwUgBQYg BgcoAgYIIAgJIAkKKAICCwALDAAMDQgCDQ4ADQ8ACQIAQgEAAAAGAgkIBgUD FwQAAAAAAAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:56:36Z</structure-indexed-at> </compound>