{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2025,1,14]],"date-time":"2025-01-14T05:16:21Z","timestamp":1736831781108,"version":"3.33.0"},"reference-count":28,"publisher":"International Union of Crystallography (IUCr)","issue":"12","license":[{"start":{"date-parts":[[2023,11,30]],"date-time":"2023-11-30T00:00:00Z","timestamp":1701302400000},"content-version":"vor","delay-in-days":0,"URL":"https:\/\/creativecommons.org\/licenses\/by\/4.0\/legalcode"},{"start":{"date-parts":[[2023,11,30]],"date-time":"2023-11-30T00:00:00Z","timestamp":1701302400000},"content-version":"tdm","delay-in-days":0,"URL":"https:\/\/creativecommons.org\/licenses\/by\/4.0\/legalcode"}],"content-domain":{"domain":["iucr.org","wiley.com","iucrj.org"],"crossmark-restriction":true},"short-container-title":["Acta Crystallogr E Cryst Commun","Acta Cryst E","Acta Cryst Sect E","Acta Crystallogr E","Acta Crystallogr Sect E","Acta Cryst E Cryst Commun","Acta Cryst Sect E Cryst Commun"],"accepted":{"date-parts":[[2023,11,22]]},"published-print":{"date-parts":[[2023,12,1]]},"abstract":"<jats:p>The title compound, C<jats:sub>15<\/jats:sub>H<jats:sub>15<\/jats:sub>F<jats:sub>3<\/jats:sub>N<jats:sub>2<\/jats:sub>O<jats:sub>3<\/jats:sub>S, crystallizes in the monoclinic system, space group <jats:italic>I<\/jats:italic>2\/<jats:italic>a<\/jats:italic>, with <jats:italic>Z<\/jats:italic> = 8. As expected, the nine-membered heterobicyclic system is virtually planar and the cyclohexyl group adopts a chair conformation. There is structural evidence for intramolecular N\u2014S...O chalcogen bonding between the benzisothiazolinone S atom and one O atom of the nitro group, approximately aligned along the extension of the covalent N\u2014S bond [N\u2014S...O = 162.7\u2005(1)\u00b0]. In the crystal, the molecules form centrosymmetric dimers through C\u2014H...O weak hydrogen bonding between a C\u2014H group of the electron-deficient benzene ring and the benzothiazolinone carbonyl O atom with an <jats:italic>R<\/jats:italic>\n                  <jats:sup>2<\/jats:sup>\n                  <jats:sub>2<\/jats:sub>(10) motif. In contrast to the previously described <jats:italic>N<\/jats:italic>-acyl 7-nitro-5-(trifluoromethyl)benzo[<jats:italic>d<\/jats:italic>]isothiazol-3(2<jats:italic>H<\/jats:italic>)-ones, the title <jats:italic>N<\/jats:italic>-cyclohexylmethyl analogue does not inhibit growth of <jats:italic>Mycobacterium aurum<\/jats:italic> and <jats:italic>Mycobacterium smegmatis in vitro<\/jats:italic>.<\/jats:p>","DOI":"10.1107\/s2056989023010137","type":"journal-article","created":{"date-parts":[[2023,11,30]],"date-time":"2023-11-30T08:41:27Z","timestamp":1701333687000},"page":"1194-1198","update-policy":"https:\/\/doi.org\/10.1107\/cm_01","source":"Crossref","is-referenced-by-count":0,"title":["Crystal structure and antimycobacterial evaluation of 2-(cyclohexylmethyl)-7-nitro-5-(trifluoromethyl)benzo[<i>d<\/i>]isothiazol-3(2<i>H<\/i>)-one"],"prefix":"10.1107","volume":"79","author":[{"ORCID":"https:\/\/orcid.org\/0000-0002-0062-7896","authenticated-orcid":true,"given":"Adrian","family":"Richter","sequence":"first","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-0357-3173","authenticated-orcid":true,"given":"Richard","family":"Goddard","sequence":"additional","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Peter","family":"Imming","sequence":"additional","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-3438-4666","authenticated-orcid":true,"given":"R\u00fcdiger W.","family":"Seidel","sequence":"additional","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]}],"member":"329","published-online":{"date-parts":[[2023,11,30]]},"reference":[{"key":"vm2292_bb1","doi-asserted-by":"crossref","first-page":"335","DOI":"10.1107\/S0021889804003528","volume":"37","author":"Allen","year":"2004","journal-title":"J. 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