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Ammonium → 4-[4-(4-Methanesulfonyl-phenoxy)-3-methyl-pyrazolo[3,4-d]pyrimidin-1-yl]-piperidine-1-carboxylic acid isopropyl ester

HRID 1116196
Notes
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Reaction equation

HRID 1116196 reaction equation
[CH3:39][N:40]([CH3:41])[CH:42]=[O:43].[CH3:3][S:4](=[O:5])(=[O:6])[c:7]1[cH:8][cH:9][c:10]([OH:13])[cH:11][cH:12]1.[CH:14]([CH3:15])([CH3:16])[O:17][C:18](=[O:19])[N:20]1[CH2:21][CH2:22][CH:23]([n:26]2[n:27][c:28]([CH3:36])[c:29]3[c:30]2[n:31][cH:32][n:33][c:34]3[Cl:35])[CH2:24][CH2:25]1.[Cl-:37].[H-:1].[NH4+:38].[Na+:2]>>[CH3:3][S:4](=[O:5])(=[O:6])[c:7]1[cH:8][cH:9][c:10]([O:13][c:34]2[c:29]3[c:28]([CH3:36])[n:27][n:26]([CH:23]4[CH2:22][CH2:21][N:20]([C:18]([O:17][CH:14]([CH3:15])[CH3:16])=[O:19])[CH2:25][CH2:24]4)[c:30]3[n:31][cH:32][n:33]2)[cH:11][cH:12]1
ParticipantsSources & evidenceReaction notes

Participants

8

Reactant 7

HCID 223AmmoniumHCID 312ChlorideHCID 923Sodium IonHCID 6228DimethylformamideHCID 1233504-(Methylsulfonyl)phenolHCID 166653HydrideHCID 579649474-(4-Chloro-3-methyl-pyrazolo[3,4-d]pyrimidin-1-yl)piperidine-1-carboxylic acid isopropyl ester

Product 1

HCID 579650154-[4-(4-Methanesulfonyl-phenoxy)-3-methyl-pyrazolo[3,4-d]pyrimidin-1-yl]-piperidine-1-carboxylic acid isopropyl ester

Sources & evidence

ORD record
ord-62c879c3e0794dcaa77fe41c87db4c11
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes