{"Aliases":["Ipsapirona","Ipsapironum","Dtxcid2025688","TVX-Q-7821","1,2-Benzisothiazol-3(2H)-one, 2-(4-(4-(2-pyrimidinyl)-1-piperazinyl)butyl)-, 1,1-dioxide","isapirone","1,1-dioxo-2-(4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl)-1,2-benzothiazol-3-one","1,1-Dioxo-2-(4-(4-pyrimidin-2-yl-piperazin-1-yl)-butyl)-1,2-dihydro-1lambda*6*-benzo(d)isothiazol-3-one","1,1-Dioxo-2-[4-(4-pyrimidin-2-yl-piperazin-1-yl)-butyl]-1,2-dihydro-1lambda*6*-benzo[d]isothiazol-3-one","TVX Q 7821","2-(4-(4-(Pyrimidin-2-yl)piperazin-1-yl)butyl)benzo[d]isothiazol-3(2H)-one 1,1-dioxide","2-[4-[4-(2-Pyrimidinyl)-1-piperazinyl]butyl]-1,2-benzisothiazol-3(2h)-one-1,1-dioxide","CHEMBL8412","Ncgc00025315-01","C19h23n5o3s","Cas-95847-70-4","Sr-01000597547","Brn 5486134","Tocris-1869","GTPL42","2-(4-(4-(2-Pyrimidinyl)-1-piperazinyl)butyl)-1,2-benzisothiazol-3(2H)-one 1,1-dioxide","Schembl79574","orb1704459","Schembl29356316","Chebi:93578","GLXC-06128","HMS3268M06","HMS3414N19","HMS3678N17","HMS3713J20","Tox21_110962","Bdbm50005127","HB1699","Mfcd00866976","Pdsp1_000744","Pdsp2_000732","Akos000278833","Tox21_110962_1","CCG-220609","Ncgc00025315-02","AS-16846","HY-19686","DB-020290","CS-0016206","NS00125565","G12743","T22871","Au-059/43515096","F979933","L000682","Sr-01000597547-1","Sr-01000597547-2","Brd-k90574421-001-01-9","Brd-k90574421-001-03-5","2-(4-(4-(2-pyrimidinyl)-1-piperazinyl)-butyl)-1,2-benzoisothiazol-3(2H)-one-1,1-dioxide","2-(4-(4-(2-pyrimidinyl)-1-piperazinyl)butyl)-1,2-benzoisothiazol-3(2H)one 1,1-dioxide","2-(4-(4-(Pyrimidin-2-yl)piperazin-1-yl)butyl)benzo[d]isothiazol-3(2H)-one1,1-dioxide","1,1-Dioxo-2-[4-(4-pyrimidin-2-yl-piperazin-1-yl)-butyl]-1,2-dihydro-1lambda*6*-benzo[d]isothiazol-3-one(Ipsapirone)","2-(4-(4-(2-Pyrimidinyl)-1-piperazinyl)butyl)-1,2-benzisothiazolin-3-one 1,1-dioxide","2-{4-[4-(Pyrimidin-2-yl)piperazin-1-yl]butyl}-1H-1lambda~6~,2-benzothiazole-1,1,3(2H)-trione","2-{4-[4-(pyrimidin-2-yl)piperazin-1-yl]butyl}-2,3-dihydro-1|E?,2-benzothiazole-1,1,3-trione"],"CAS":"95847-70-4","ChemicalClasses":["benzylamine"],"Chirality":"achiral","DTXSID":"4045688","EliminationHalfLife":"1.3 – 2.7 hours{-{medcn|date=November 2023}-}","Erowid Experience Reports":[],"Esters":[],"Formating":[],"HMDB ID":"HMDB0253573","HeavyAtomCount":28,"IUPACName":"1,1-dioxo-2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-1,2-benzothiazol-3-one","InChI":"InChI=1S/C19H23N5O3S/c25-18-16-6-1-2-7-17(16)28(26,27)24(18)11-4-3-10-22-12-14-23(15-13-22)19-20-8-5-9-21-19/h1-2,5-9H,3-4,10-15H2","InChIKey":"TZJUVVIWVWFLCD-UHFFFAOYSA-N","MeSH Headers":[{"Id":"M0126938","Link":"https://id.nlm.nih.gov/mesh/M0126938.html","Name":"ipsapirone","Ref":24},{"Id":"DescTree","Link":"https://www.nlm.nih.gov/mesh/meshhome.html","Name":"MeSH Tree","Ref":25},{"Id":"PubMed from MeSH","Link":"https://www.nlm.nih.gov/mesh/meshhome.html","Name":null,"Ref":36},{"Id":"M0021771","Link":"https://id.nlm.nih.gov/mesh/M0021771.html","Name":"Anti-Anxiety Agents","Ref":37},{"Id":"M0026371","Link":"https://id.nlm.nih.gov/mesh/M0026371.html","Name":"Serotonin Receptor Agonists","Ref":38}],"MeSH Pharmacological Classification":[{"Id":"M0021771","Link":"https://id.nlm.nih.gov/mesh/M0021771.html","Name":"Anti-Anxiety Agent","Ref":37},{"Id":"M0026371","Link":"https://id.nlm.nih.gov/mesh/M0026371.html","Name":"Serotonin Receptor Agonist","Ref":38}],"MolecularFormula":"C\u003csub\u003e19\u003c/sub\u003eH\u003csub\u003e23\u003c/sub\u003eN\u003csub\u003e5\u003c/sub\u003eO\u003csub\u003e3\u003c/sub\u003eS","MolecularWeight":"401.5 g/mol","PubChemId":56971,"PubChemTitle":"Ipsapirone","Reagents":[],"Records":{"UNII":{"Impurities":[]}},"Reddit Experience Reports":[],"RefChem":"148673","RefCount":3,"RefCur":"","References":[{"Name":"Wikipedia","Urls":[{"Link":"https://en.wikipedia.org/wiki/Ipsapirone","Name":"Ipsapirone","Sub":false}]},{"Name":"Wikidata","Urls":[{"Link":"https://www.wikidata.org/wiki/Q6065448","Name":"Ipsapirone","Sub":false}]},{"Name":"DrugBank","Urls":[{"Link":"https://go.drugbank.com/DB20133","Name":"Ipsapirone","Sub":false}]},{"Name":"PubChem","Urls":[{"Link":"https://pubchem.ncbi.nlm.nih.gov/compound/56971","Name":"Ipsapirone","Sub":false}]},{"Name":"Common Chemistry","Urls":[{"Link":"https://commonchemistry.cas.org/detail?cas_rn=95847-70-4","Name":"Ipsapirone","Sub":false}]},{"Name":"HMDB","Urls":[{"Link":"https://hmdb.ca/metabolites/HMDB0253573","Name":"Ipsapirone","Sub":false}]},{"Name":"UNII","Urls":[{"Link":"https://gsrs.ncats.nih.gov/ginas/app/ui/substances/6J9B11MN0K","Name":"Ipsapirone","Sub":false}]},{"Name":"EPA DSSTox","Urls":[{"Link":"https://comptox.epa.gov/dashboard/chemical/details/DTXSID4045688","Name":"Ipsapirone","Sub":false}]}],"Refs":["National Center for Biotechnology Information. PubChem Compound Summary for CID 56971, Ipsapirone. Accessed May 31, 2026. \u003ca href=https://pubchem.ncbi.nlm.nih.gov/compound/56971\u003ehttps://pubchem.ncbi.nlm.nih.gov/compound/56971\u003c/a\u003e","U.S. Food and Drug Administration; National Center for Advancing Translational Sciences. Ipsapirone. UNII: 6J9B11MN0K. Global Substance Registration System. Accessed May 31, 2026. \u003ca href=https://gsrs.ncats.nih.gov/ginas/app/beta/substances/6J9B11MN0K\u003ehttps://gsrs.ncats.nih.gov/ginas/app/beta/substances/6J9B11MN0K\u003c/a\u003e"],"SMILES":"C1CN(CCN1CCCCN2C(=O)C3=CC=CC=C3S2(=O)=O)C4=NC=CC=N4","SaltData":[{"AcidCount":1,"Amine":"Ipsapirone","AmineCount":1,"Formula":"Cl","Name":"hydrochloride","RName":"hydrochloride","Structure":"\u003csvg xmlns=\"http://www.w3.org/2000/svg\" preserveAspectRatio=\"none\" style=\"display:block\" viewBox=\"0 0 212.799 72.086\"\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=\".8\"\u003e\u003cpath fill=\"#fff\" stroke=\"none\" d=\"M0 0h213v73H0z\"/\u003e\u003cg class=\"mol\"\u003e\u003cpath d=\"m119.532 3.06 15.248.003M134.78 3.063l5.385 9.316M140.168 20.151l-5.375 9.313M134.793 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