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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 729315Generated: November 1, 2026

HCID 10513804, compound → HCID 11640734, compound

https://huagongshe.com/reaction/729315

Reaction equation

Participants

RoleNameHCIDCharge
ReactantHCID 10513804HCID 10513804—
Reactant2-Butyl-4-chloro-5-phenylisothiazol-3(2H)-one 1,1-dioxideHCID 67242623—
SolventAcetonitrileHCID 6342—
ProductHCID 11640734HCID 1164073429%

Reaction Conditions

Temperature160 °C

Reaction Steps

A mixture of 2-butyl-4-chloro-5-phenylisothiazol-3(2H)-one 1,1-dioxide (1.000 g, 3.336 mmol), tert-butyl 5-amino-1-benzofuran-2-carboxylate (0.778 g, 3.336 mmol) and TEA (0.340 ml, 2.471 mmol) in MeCN (5 ml) was heated in a microwave reactor at 160° C. for 1.5 h. The reaction mixture was evaporated and the residue was purified by flash chromatography using 5:1 DCM/EtOAc (+1% AcOH) as eluent to give the title compound (0.425 g, 29%). 1H NMR (500 MHz CD3OD); δ 13.54 (bs, 1H), 9.63 (s, 1H), 7.34 (s, 1H), 7.29 (d, 1H), 7.14-6.97 (m, 6H), 3.71 (t, 2H), 1.75 (qnt, 2H), 1.42 (sex, 2H), 0.95 (t, 2H); Mass Spectrum: M−H+ 439

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07582629B2
Source datasetuspto-grants-2009_09
ORD IDord-f895523c37634cdeaba94e6ec793b528
Source noteuspto-grants-2009_09