Bicarbonate Ion → N-(1-tert-butyl-3-(3-methoxyphenethyl)-1H-pyrazol-5-yl)-4-(4-(methylsulfonyl)piperazin-1-yl)benzamide
Reaction equation
[C:50](=[O:51])([O-:52])[OH:53].[C:6]([CH3:7])([CH3:8])([CH3:9])[n:10]1[n:11][c:12]([CH2:30][CH2:31][c:32]2[cH:33][c:34]([O:38][CH3:39])[cH:35][cH:36][cH:37]2)[cH:13][c:14]1[NH:15][C:16]([c:17]1[cH:18][cH:19][c:20]([N:23]2[CH2:24][CH2:25][NH:26][CH2:27][CH2:28]2)[cH:21][cH:22]1)=[O:29].[CH3:1][S:2]([Cl:3])(=[O:4])=[O:5].[CH3:40][CH2:41][N:42]([CH2:43][CH3:44])[CH2:45][CH3:46].[Cl:47][CH2:48][Cl:49].[Na+:54]>>[CH3:1][S:2](=[O:4])(=[O:5])[N:26]1[CH2:25][CH2:24][N:23]([c:20]2[cH:19][cH:18][c:17]([C:16]([NH:15][c:14]3[n:10]([C:6]([CH3:7])([CH3:8])[CH3:9])[n:11][c:12]([CH2:30][CH2:31][c:32]4[cH:33][c:34]([O:38][CH3:39])[cH:35][cH:36][cH:37]4)[cH:13]3)=[O:29])[cH:22][cH:21]2)[CH2:28][CH2:27]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-17b9eaaf08c84b10954a4b09a11c5e98
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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