Acetonitrile → 4-Diethylamino-6-(3-trifluoromethyl-phenyl)-pyrimidine-2-carbonitrile

Reaction equation

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

Participants

Reactant 3

HCID 6342Acetonitrile

HCID 8471Triethylamine

HCID 866125024-Chloro-6-(3-trifluoromethylphenyl)-pyrimidine-2-carbonitrile

Product 1

HCID 688222324-Diethylamino-6-(3-trifluoromethyl-phenyl)-pyrimidine-2-carbonitrile

Sources & evidence

ORD record: ord-35bfac241d1e4a70be3a34aadd659e3b
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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