Back
HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1785333Generated: October 27, 2026

Allyl Isothiocyanate → 1-Allyl-3-[4-(5-bromo-4-prop-2-ynylamino-pyrimidin-2-ylamino)-phenyl]-thiourea

https://huagongshe.com/reaction/1785333

Reaction equation

Participants

RoleNameHCIDCharge
ReactantAllyl IsothiocyanateHCID 5971—
ReactantN2-(4-Amino-phenyl)-5-bromo-N4-prop-2-ynyl-pyrimidine-2,4-diamineHCID 57593369—
SolventAcetonitrileHCID 6342—
Product1-Allyl-3-[4-(5-bromo-4-prop-2-ynylamino-pyrimidin-2-ylamino)-phenyl]-thioureaHCID 57593553—

Reaction Steps

N2-(4-Amino-phenyl)-5-bromo-N4-prop-2-ynyl-pyrimidine-2,4-diamine (100 mg, 0.3 mmole, prepared in analogy procedure 21) was dissolved in acetonitrile (10 ml) and allyl isothiocyanate (1 ml) was added at room temperature. The reaction mixture was heated under reflux for 3 hours, the solvent removed under reduced pressure and 1-Allyl-3[4-(5-bromo-4-prop-2-ynylamino-pyrimidin-2-ylamino)-phenyl]-thiourea was crystallized from acetone/ethyl acetate/hexanes. Yield 37 mg. ESI-MS: 418.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07504410B2
Source datasetuspto-grants-2009_03
ORD IDord-69dd0512a0984eb9a6ff0183a16df756
Source noteuspto-grants-2009_03