Acetate → 4-cyclopropyl-5-fluoro-N-[3-methyl-5-(1,3-thiazol-5-yl)phenyl]pyrimidin-2-amine

HRID 104804Notes

Reaction equation

HRID 104804 reaction equation
[C:25](=[O:26])([O-:27])[O-:28].[CH3:1][c:2]1[cH:3][c:4]([NH2:5])[cH:6][c:7](-[c:9]2[cH:10][n:11][cH:12][s:13]2)[cH:8]1.[Cl:14][c:15]1[n:16][cH:17][c:18]([F:24])[c:19]([CH:21]2[CH2:22][CH2:23]2)[n:20]1.[Cs+:29].[Cs+:30].[O-:32][C:33]([CH3:34])=[O:35].[O-:36][C:37]([CH3:38])=[O:39].[Pd+2:31]>>[CH3:1][c:2]1[cH:3][c:4]([NH:5][c:15]2[n:16][cH:17][c:18]([F:24])[c:19]([CH:21]3[CH2:22][CH2:23]3)[n:20]2)[cH:6][c:7](-[c:9]2[cH:10][n:11][cH:12][s:13]2)[cH:8]1

Participants

7

Reactant 6

HCID 175Acetate2×HCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 58456365HCID 58456365, compoundHCID 772310692-chloro-4-cyclopropyl-5-fluoroPyrimidine

Product 1

HCID 584562534-cyclopropyl-5-fluoro-N-[3-methyl-5-(1,3-thiazol-5-yl)phenyl]pyrimidin-2-amine

Sources & evidence

ORD record
ord-1e9550e971f74f5fa80880536fc759f9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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