Sodium ion → N-(5-methyl-2-pyridinyl)-2-[1-(2-methylsulfonylphenyl)pyrazolo[5,4-d]pyrimidin-4-yl]oxy-3-propan-2-yloxypropanamide

HRID 1117216Notes

Reaction equation

HRID 1117216 reaction equation
[CH2:45]1[O:46][CH2:47][CH2:48][CH2:49]1.[CH3:6][S:7](=[O:8])(=[O:9])[c:10]1[c:11](-[n:16]2[n:17][cH:18][c:19]3[c:20]2[n:21][cH:22][n:23][c:24]3[OH:25])[cH:12][cH:13][cH:14][cH:15]1.[H-:26].[Na+:27].[OH:28][CH:29]([C:30](=[O:31])[NH:32][c:33]1[n:34][cH:35][c:36]([CH3:39])[cH:37][cH:38]1)[CH2:40][O:41][CH:42]([CH3:43])[CH3:44].[P:1]([Cl:2])([Cl:3])([Cl:4])=[O:5]>>[CH3:6][S:7](=[O:8])(=[O:9])[c:10]1[c:11](-[n:16]2[n:17][cH:18][c:19]3[c:20]2[n:21][cH:22][n:23][c:24]3[O:25][CH:29]([C:30](=[O:31])[NH:32][c:33]2[n:34][cH:35][c:36]([CH3:39])[cH:37][cH:38]2)[CH2:40][O:41][CH:42]([CH3:43])[CH3:44])[cH:12][cH:13][cH:14][cH:15]1

Participants

7

Reactant 6

HCID 923Sodium ionHCID 8028TetrahydrofuranHCID 24813Phosphorus oxychlorideHCID 166653HydrideHCID 66813153HCID 66813153, compoundHCID 178504711HCID 178504711, compound

Product 1

HCID 76550365N-(5-methyl-2-pyridinyl)-2-[1-(2-methylsulfonylphenyl)pyrazolo[5,4-d]pyrimidin-4-yl]oxy-3-propan-2-yloxypropanamide

Sources & evidence

ORD record
ord-6658e1fcac1046bf8dad907aa7c483a0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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