Sodium ion → HCID 57990442, compound

HRID 2326593Notes

Reaction equation

HRID 2326593 reaction equation
[C:39](=[O:40])([O-:41])[O-:42].[Cl:1][c:2]1[n:3][c:4]([NH:22][c:23]2[cH:24][cH:25][c:26]([F:29])[cH:27][cH:28]2)[c:5]2[c:6]([n:7]1)[n:8]([S:12](=[O:13])(=[O:14])[c:15]1[cH:16][cH:17][c:18]([CH3:19])[cH:20][cH:21]1)[cH:9][c:10]2[I:11].[Na+:43].[Na+:44].[O:45]1[CH2:46][CH2:47][O:48][CH2:49][CH2:50]1.[n:30]1[cH:31][cH:32][c:33]([B:36]([OH:37])[OH:38])[cH:34][cH:35]1>>[Cl:1][c:2]1[n:3][c:4]([NH:22][c:23]2[cH:24][cH:25][c:26]([F:29])[cH:27][cH:28]2)[c:5]2[c:6]([n:7]1)[n:8]([S:12](=[O:13])(=[O:14])[c:15]1[cH:16][cH:17][c:18]([CH3:19])[cH:20][cH:21]1)[cH:9][c:10]2-[c:33]1[cH:32][cH:31][n:30][cH:35][cH:34]1

Participants

6

Reactant 5

HCID 923Sodium ion2×HCID 19660Carbonate IonHCID 312751,4-DioxaneHCID 2734379(Pyridin-4-yl)boronic acidHCID 579904152-chloro-N-(4-fluorophenyl)-5-iodo-7-tosyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine

Product 1

HCID 57990442HCID 57990442, compound

Sources & evidence

ORD record
ord-bdeba78462ff40408d36bc2e2d2d3c73
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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