Water → 6-[4-[4-[2-[4-(Methylsulfonyl)piperazin-1-yl]ethoxy]phenyl]piperidin-1-yl]-3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazine
Reaction equation
[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].[N:6]1([CH2:12][CH2:13][O:14][c:15]2[cH:16][cH:17][c:18]([CH:21]3[CH2:22][CH2:23][N:24]([c:27]4[cH:28][cH:29][c:30]5[n:31]([n:32]4)[c:33]([C:36]([F:37])([F:38])[F:39])[n:34][n:35]5)[CH2:25][CH2:26]3)[cH:19][cH:20]2)[CH2:7][CH2:8][NH:9][CH2:10][CH2:11]1.[OH2:50]>>[CH3:1][S:2](=[O:4])(=[O:5])[N:9]1[CH2:8][CH2:7][N:6]([CH2:12][CH2:13][O:14][c:15]2[cH:16][cH:17][c:18]([CH:21]3[CH2:22][CH2:23][N:24]([c:27]4[cH:28][cH:29][c:30]5[n:31]([n:32]4)[c:33]([C:36]([F:37])([F:38])[F:39])[n:34][n:35]5)[CH2:25][CH2:26]3)[cH:19][cH:20]2)[CH2:11][CH2:10]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-65f0faf79ea847839c617e249ec96ab6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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