Ethanolamine → 3-Bromo-5-[(2-hydroxyethyl)amino]-2-pyrazinecarbonitrile

Reaction equation

[Br:5][c:6]1[c:7]([C:13]#[N:14])[n:8][cH:9][c:10]([Cl:12])[n:11]1.[CH2:15]([N:16]([CH:17]([CH3:18])[CH3:19])[CH:20]([CH3:21])[CH3:22])[CH3:23].[NH2:1][CH2:2][CH2:3][OH:4].[O:24]1[CH2:25][CH2:26][O:27][CH2:28][CH2:29]1>>[NH:1]([CH2:2][CH2:3][OH:4])[c:10]1[cH:9][n:8][c:7]([C:13]#[N:14])[c:6]([Br:5])[n:11]1

Participants

Reactant 4

HCID 700Ethanolamine

HCID 312751,4-Dioxane

HCID 81531Diisopropylethylamine

HCID 187532003-Bromo-5-chloropyrazine-2-carbonitrile

Product 1

HCID 187532053-Bromo-5-[(2-hydroxyethyl)amino]-2-pyrazinecarbonitrile

Sources & evidence

ORD record: ord-1a5c89b83e01409990deb498a59ad39c
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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