{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,10,18]],"date-time":"2026-10-18T11:45:28Z","timestamp":1792323928050,"version":"4.4.0"},"reference-count":33,"publisher":"Wiley","issue":"11","license":[{"start":{"date-parts":[[2025,7,28]],"date-time":"2025-07-28T00:00:00Z","timestamp":1753660800000},"content-version":"vor","delay-in-days":0,"URL":"http:\/\/onlinelibrary.wiley.com\/termsAndConditions#vor"},{"start":{"date-parts":[[2025,7,28]],"date-time":"2025-07-28T00:00:00Z","timestamp":1753660800000},"content-version":"tdm","delay-in-days":0,"URL":"http:\/\/doi.wiley.com\/10.1002\/tdm_license_1.1"}],"content-domain":{"domain":["onlinelibrary.wiley.com"],"crossmark-restriction":true},"short-container-title":["Chemistry &amp;amp; Biodiversity"],"published-print":{"date-parts":[[2025,11]]},"abstract":"<jats:title>ABSTRACT<\/jats:title>\n                  <jats:p>\n                    A novel series of quinazolinonethioacetohydrazide\u20101,2,3\u2010triazole hybrids\n                    <jats:bold>13a\u2013l<\/jats:bold>\n                    was synthesized via a multi\u2010step process starting from isatoic anhydride, followed by the condensation reaction with carbon disulfide (CS\n                    <jats:sub>2<\/jats:sub>\n                    ), hydrazide formation, and the conduction of click chemistry reaction. Different spectroscopic techniques structurally characterized the synthesized compounds. The anticancer activity of the compounds was evaluated against MCF\u20107 (breast) and SW480 (colon) cancer cell lines, while HEK 293 (normal cells) was used as a noncancerous control. Compound\n                    <jats:bold>13c<\/jats:bold>\n                    exhibited the most potent and selective cytotoxicity, particularly against SW480 (IC\n                    <jats:sub>50<\/jats:sub>\n                    \u00a0=\u00a029.83\u00a0\u00b5M) and MCF\u20107 (IC\n                    <jats:sub>50<\/jats:sub>\n                    \u00a0=\u00a017.32\u00a0\u00b5M) cancer cell lines, while demonstrating negligible toxicity toward normal HEK 293 cells. Cell cycle analysis indicated that\n                    <jats:bold>13c<\/jats:bold>\n                    induced G2\/M phase arrest and promoted apoptosis in MCF\u20107 cells, as confirmed by annexin V\/PI staining. In silico docking studies revealed strong binding of\n                    <jats:bold>13c<\/jats:bold>\n                    to the vascular endothelial growth factor (VEGF) receptor, with key hydrogen bonding and \u03c0\u2013\u03c0 interactions at critical active\u2010site residues. In addition, 100\u00a0ns molecular dynamics simulations validated the stability of the VEGF\u2013\n                    <jats:bold>13c<\/jats:bold>\n                    complex and the persistence of binding interactions, supporting its role as a strong and stable VEGFR inhibitor.\n                  <\/jats:p>","DOI":"10.1002\/cbdv.202501526","type":"journal-article","created":{"date-parts":[[2025,7,28]],"date-time":"2025-07-28T18:45:21Z","timestamp":1753728321000},"update-policy":"https:\/\/doi.org\/10.1002\/crossmark_policy","source":"Crossref","is-referenced-by-count":1,"title":["Design, Synthesis, Anticancer Properties, and Molecular Dynamics of New Quinazolinonethioacetohydrazide\u20101,2,3\u2010Triazoles"],"prefix":"10.1002","volume":"22","author":[{"given":"Aida","family":"Iraji","sequence":"first","affiliation":[{"name":"Stem Cells Technology Research Center Shiraz University of Medical Sciences  Shiraz Iran"},{"name":"Central Research Laboratory Shiraz University of Medical 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