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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1917221Generated: November 2, 2026

HCID 66704472, compound → HCID 178453755, compound

https://huagongshe.com/reaction/1917221

Reaction equation

Participants

RoleNameHCIDCharge
ReactantHCID 66704472HCID 66704472—
ReactantMethyl thiophene-2-carbimidothioate hydroiodideHCID 66704664—
CatalystPalladiumHCID 23938—
SolventEthanolHCID 702—
SolventDichloromethaneHCID 6344—
ProductHCID 178453755HCID 17845375547.6%

Reaction Steps

A stirred suspension of tert-butyl 2-hydroxyethyl(2-(6-nitro-2H-benzo[b][1,4]thiazin-4(3H)-yl)ethyl)carbamate (590 mg, 1.539 mmol) and palladium, 10 wt. % on activated carbon (164 mg, 0.154 mmol) in ethanol (10 mL) was stirred at room temperature under an atmosphere of hydrogen (1 atm) for 2 hours (yellow color disappears). To this mixture was then added methyl thiophene-2-carbimidothioate hydroiodide (878 mg, 3.08 mmol), and the resulting mixture was stirred overnight at room temperature. The mixture was then diluted with dichloromethane and then filtered through Celite. The filtrate was then diluted with water and extracted with dichloromethane (4×). The combined organics were dried, filtered, concentrated, and then chromatographed in ethyl acetate, giving the desired product (339 mg, 47.6%) as a yellow foam. 1H NMR (DMSO-d6) δ 7.69 (s, 1H), 7.58 (d, J=4.8 Hz, 1H), 7.07 (t, J=4.2 Hz, 1H), 6.41-6.25 (m, 3H), 6.08 (d, J=8.1 Hz, 1H), 4.71-4.65 (m, 1H), 3.63-3.54 (m, 2H), 3.49-3.33 (m, 6H), 3.27-3.15 (m, 2H), 3.02-2.94 (m, 2H), 1.39-1.29 (m, 9H); ESI-MS (m/z, %): 463 (MH+, 100).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08618286B2
Source datasetuspto-grants-2013_12
ORD IDord-fcaeeb9fda97485fb34f23d71e8d0484
Source noteuspto-grants-2013_12