75392 <common-name>3-Allyl-5,5-dimethyl-2-thioxoimidazolidin-4-one</common-name> <description>3-Allyl-5,5-dimethyl-2-thioxoimidazolidin-4-one belongs to the amino acids, peptides, and analogues, a subclass of carboxylic acids and derivatives within the organic compounds. It has the chemical formula C8H12N2O1S1 and an average molecular weight of 184.26 g/mol.</description> <cas>53517-95-6</cas> <pubchem-id>3034733</pubchem-id> <chemical-formula>C8H12N2O1S1</chemical-formula> <weight nil="true"/> <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">2026-04-04T03:53:53Z</created-at> <updated-at type="dateTime">2026-04-04T03:53:53Z</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>CC1(C)NC(=S)N(CC=C)C1=O</moldb-smiles> <moldb-formula>C8H12N2O1S1</moldb-formula> <moldb-inchi>InChI=1S/C8H12N2OS/c1-4-5-10-6(11)8(2,3)9-7(10)12/h4H,1,5H2,2-3H3,(H,9,12)</moldb-inchi> <moldb-inchikey>SHWHBFYMRFDNDU-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">184.26</moldb-average-mass> <moldb-mono-mass type="decimal">184.067034</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp nil="true"/> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>2299146</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>CHEM071285</chemdb-id> <dsstox-id>DTXSID60201733</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00032779</susdat-id> <iupac>5,5-dimethyl-3-prop-2-enyl-2-sulfanylideneimidazolidin-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>Organic acids and derivatives</superklass> <klass>Carboxylic acids and derivatives</klass> <subklass>Amino acids, peptides, and analogues</subklass> <paper-count type="integer">0</paper-count> <sync-id>CED0131770</sync-id> <structure-inchikey>SHWHBFYMRFDNDU-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>800040000000000200000000000000000000000000110000000000000020000000000000000000020000000000000000000000000000000000000000000000080000000000000020000000000200000000000000000000000000000000000000000000000800000000000108000000000000004000000000000048000000000000200000000000000000000000000000000000000020000000000000000010000200080000000000000000000000000000010000010000000000000040000000000000040000000000000000040000000000000000000000000800000000000000000000000000000000000000000000000010000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAMAAAADAAAAIABBgBgAAAAAQMGACAAAAAE BgBgAAAAAQMHAGgAAAADAgEGACgAAAADBBAAKAAAAAMCBwAoAAAAAwMGAGAA AAACAgYAaAAAAAMDAQYAaAAAAAMCAgYAKAAAAAMECAAoAAAAAwILAAEAAQIA AQMAAwQgBAUoAgQGIAYHAAcIAAgJCAIGCiAKCygCCgEAQgEAAAAFAQMEBgoX BAAAAAAAAAAW </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:23:40Z</structure-indexed-at> </compound>