Sodium ion → HCID 178442440, compound

HRID 2331120Notes

Reaction equation

HRID 2331120 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([CH2:8][CH:9]([NH:10][CH3:11])[c:12]2[nH:13][cH:14][c:15]([CH2:17][C:18]([CH2:19][CH3:20])([CH3:21])[CH3:22])[n:16]2)[cH:6][cH:7]1.[CH3:29][n:30]1[n:31][cH:32][c:33]([B:35]2[O:36][C:37]([CH3:38])([CH3:39])[C:40]([CH3:41])([CH3:42])[O:43]2)[cH:34]1.[CH3:45][N:46]([CH3:47])[CH:48]=[O:49].[Na+:23].[Na+:24].[O-:25][C:26](=[O:27])[O-:28].[OH2:44].[OH2:50]>>[c:2]1(-[c:33]2[cH:32][n:31][n:30]([CH3:29])[cH:34]2)[cH:3][cH:4][c:5]([CH2:8][CH:9]([NH:10][CH3:11])[c:12]2[nH:13][cH:14][c:15]([CH2:17][C:18]([CH2:19][CH3:20])([CH3:21])[CH3:22])[n:16]2)[cH:6][cH:7]1

Participants

7

Reactant 6

HCID 923Sodium ion2×HCID 962Water2×HCID 6228DimethylformamideHCID 19660Carbonate IonHCID 27739871-Methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazoleHCID 178442429HCID 178442429, compound

Product 1

HCID 178442440HCID 178442440, compound

Sources & evidence

ORD record
ord-7174a26d73bc486aa5b5b5e1e320cca1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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