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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2374935Generated: October 30, 2026

HCID 68872676, compound → HCID 135984674, compound

https://huagongshe.com/reaction/2374935

Reaction equation

Participants

RoleNameHCIDCharge
ReactantHCID 68872676HCID 68872676—
ReactantHCID 178513185HCID 178513185—
SolventEthanolHCID 702—
ProductHCID 135984674HCID 13598467492.3%

Reaction Steps

A solution of ethyl 2-oxo-3-{[3-(trifluoromethyl)benzoyl]amino}butanoate (8.75 g, 27.6 mmol) and aminoguanidine bicarbonate (3.75 g, 27.6 mmol) in EtOH(aq) (80%, 200 mL) was heated at reflux for 3h. Concentration gave crude N-[1-(3-amino-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl)ethyl]-3-(trifluoromethyl)benzamide (8.34 g) as a colourless solid which was used without further purification. 1H NMR (DMSO-d6): δ8.87 (d, J=7.5 Hz, 1H), 8.23 (s, 1H), 8.20-8.15 (m, 2H), 7.93-7.89 (m, 1H), 7.75-7.69 (m, 1H), 7.00 (bs, 1H), 5.16 (p, J=7.1 Hz, 1H), 1.40 (d, J=7.1 Hz, 3H). MS m/z 326 (M−1).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07462614B2
Source datasetuspto-grants-2008_12
ORD IDord-d803ca7c09e646c49cfed600d979eece
Source noteuspto-grants-2008_12