{"Abbreviation":"","Aliases":["Methituralum","Metitural","5-(1-methylbutyl)-5-(2-methylsulfanylethyl)-2-thioxo-hexahydropyrimidine-4,6-dione","6-(1-methylbutyl)-5-(2-(methylthio)ethyl)-2-thiobarbituric acid","Dihydro-5-(1-methylbutyl)-5-(2-(methylthio)ethyl)-2-thioxo-4,6(1H,5H)-pyrimidinedione","Thiomethibumalum","5-(1-Methylbutyl)-5-(2-(methylthio)ethyl)-2-thiobarbituric acid","AC1MHTWF","C07558","6-(1-methylbutyl)-5-(2-(methylthio)ethyl)- 2-thiobarbituric acid","4,6-(1H,5H)-Pyrimidinedione, dihydro-5-(1-methylbutyl)-5-(2-(methylthio)ethyl)-2-thioxo-","5-[2-(Methylsulfanyl)ethyl]-5-(pentan-2-yl)-2-sulfanylidene-1,3-diazinane-4,6-dione"],"CAS":"467-43-6","ChEBI":"CHEBI:6831","ChEMBL":"CHEMBL2104624","ChemicalClasses":["thiobarbiturate"],"Chirality":"racemic","EliminationHalfLife":"","Erowid Experience Reports":[],"Esters":[],"Formating":[],"HeavyAtomCount":18,"IUPACName":"5-(2-methylsulfanylethyl)-5-pentan-2-yl-2-sulfanylidene-1,3-diazinane-4,6-dione","InChI":"InChI=1S/C12H20N2O2S2/c1-4-5-8(2)12(6-7-18-3)9(15)13-11(17)14-10(12)16/h8H,4-7H2,1-3H3,(H2,13,14,15,16,17)","InChIKey":"KEMCRVSPPRNENL-UHFFFAOYSA-N","MolecularFormula":"C\u003csub\u003e12\u003c/sub\u003eH\u003csub\u003e20\u003c/sub\u003eN\u003csub\u003e2\u003c/sub\u003eO\u003csub\u003e2\u003c/sub\u003eS\u003csub\u003e2\u003c/sub\u003e","MolecularWeight":"288.4 g/mol","Opticalactivity":"( + / - )","PubChemId":3032307,"RefCount":3,"RefCur":"","References":[{"Name":"Wikipedia","Urls":[{"Link":"https://en.wikipedia.org/wiki/Methitural","Name":"Methitural","Sub":false}]},{"Name":"Wikidata","Urls":[{"Link":"https://www.wikidata.org/wiki/Q6823665","Name":"Methitural","Sub":false}]},{"Name":"PubChem","Urls":[{"Link":"https://pubchem.ncbi.nlm.nih.gov/compound/3032307","Name":"Methitural","Sub":false}]},{"Name":"ChEMBL","Urls":[{"Link":"https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL2104624","Name":"Methitural","Sub":false}]},{"Name":"ChEBI","Urls":[{"Link":"https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:6831","Name":"Methitural","Sub":false}]},{"Name":"Common Chemistry","Urls":[{"Link":"https://commonchemistry.cas.org/detail?cas_rn=467-43-6","Name":"Methitural","Sub":false}]},{"Name":"KEGG","Urls":[{"Link":"https://www.kegg.jp/entry/C07558","Name":"Methitural","Sub":false}]},{"Name":"UNII","Urls":[{"Link":"https://gsrs.ncats.nih.gov/ginas/app/ui/substances/DZQ457UJ3Y","Name":"Methitural","Sub":false}]},{"Name":"EPA DSSTox","Urls":[{"Link":"https://comptox.epa.gov/dashboard/chemical/details/DTXSID10861962","Name":"Methitural","Sub":false}]}],"Refs":["National Center for Biotechnology Information. PubChem Compound Summary for CID 3032307, Methitural. Accessed July 13, 2025. \u003ca href=https://pubchem.ncbi.nlm.nih.gov/compound/3032307\u003ehttps://pubchem.ncbi.nlm.nih.gov/compound/3032307\u003c/a\u003e","U.S. Food and Drug Administration; National Center for Advancing Translational Sciences. Methitural. UNII: DZQ457UJ3Y. Global Substance Registration System. Accessed July 13, 2025. \u003ca href=https://gsrs.ncats.nih.gov/ginas/app/beta/substances/DZQ457UJ3Y\u003ehttps://gsrs.ncats.nih.gov/ginas/app/beta/substances/DZQ457UJ3Y\u003c/a\u003e"],"SMILES":"CCCC(C)C1(C(=O)NC(=S)NC1=O)CCSC","SaltData":[],"Salts":[],"Scheduling":[],"StereoisomerData":[{"Aliases":null,"PubChemId":null,"SMILES":"CCC[C@H](C)C1(CCSC)C(=O)NC(=S)NC1=O","Structure":"\u003csvg xmlns=\"http://www.w3.org/2000/svg\" preserveAspectRatio=\"none\" style=\"display:block\" viewBox=\"0 0 79.793 101.813\"\u003e\u003crect width=\"100%\" height=\"100%\" fill=\"#fff\"/\u003e\u003cdesc\u003eGenerated by the Chemistry Development Kit (http://github.com/cdk)\u003c/desc\u003e\u003cg fill=\"#3050f8\" stroke=\"#000\" stroke-linecap=\"round\" stroke-linejoin=\"round\" stroke-width=\".7\"\u003e\u003cpath fill=\"#fff\" stroke=\"none\" d=\"M0 0h80v102H0z\"/\u003e\u003cg class=\"mol\"\u003e\u003cpath d=\"m59.751 1.009 5.209 14.322M64.96 15.331l-9.798 11.672M55.162 27.003l5.209 14.322\" 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