Sodium ion → 4-[1-(5-Bromopyrimidin-2-yl)piperidin-4-yl]oxy-7-(2-fluoro-4-methylsulfonylphenyl)-5,6-dihydropyrrolo[2,3-d]pyrimidine

HRID 676744Notes

Reaction equation

HRID 676744 reaction equation
[Br:1][c:2]1[cH:3][n:4][c:5]([N:8]2[CH2:9][CH2:10][CH:11]([OH:14])[CH2:12][CH2:13]2)[n:6][cH:7]1.[CH2:38]1[O:39][CH2:40][CH2:41][CH2:42]1.[Cl:15][c:16]1[c:17]2[c:18]([n:19][cH:20][n:21]1)[N:22]([c:25]1[c:26]([F:35])[cH:27][c:28]([S:31](=[O:32])(=[O:33])[CH3:34])[cH:29][cH:30]1)[CH2:23][CH2:24]2.[H-:37].[Na+:36]>>[Br:1][c:2]1[cH:3][n:4][c:5]([N:8]2[CH2:9][CH2:10][CH:11]([O:14][c:16]3[c:17]4[c:18]([n:19][cH:20][n:21]3)[N:22]([c:25]3[c:26]([F:35])[cH:27][c:28]([S:31](=[O:32])(=[O:33])[CH3:34])[cH:29][cH:30]3)[CH2:23][CH2:24]4)[CH2:12][CH2:13]2)[n:6][cH:7]1

Participants

6

Reactant 5

HCID 923Sodium ionHCID 8028TetrahydrofuranHCID 166653HydrideHCID 46411251-(5-Bromopyrimidin-2-yl)piperidin-4-olHCID 426368224-Chloro-7-(2-fluoro-4-(methylsulfonyl)phenyl)-6,7-dihydro-5H-pyrrolo[2,3-D]pyrimidine

Product 1

HCID 441775904-[1-(5-Bromopyrimidin-2-yl)piperidin-4-yl]oxy-7-(2-fluoro-4-methylsulfonylphenyl)-5,6-dihydropyrrolo[2,3-d]pyrimidine

Sources & evidence

ORD record
ord-750757c9dce04956bdbe88c8c437d98b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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