Dimethyl Sulfoxide → 8-(6-(4-(1-(4-Fluorophenyl)ethyl)piperazin-1-yl)pyrimidin-4-yloxy)isoquinoline
Reaction equation
[C:34](=[O:35])([O-:36])[O-:37].[CH3:40][S:41]([CH3:42])=[O:43].[Cs+:38].[Cs+:39].[F:1][c:2]1[n:3][cH:4][n:5][c:6]([N:8]2[CH2:9][CH2:10][N:11]([CH:14]([CH3:15])[c:16]3[cH:17][cH:18][c:19]([F:22])[cH:20][cH:21]3)[CH2:12][CH2:13]2)[cH:7]1.[OH2:44].[cH:23]1[n:24][cH:25][cH:26][c:27]2[cH:28][cH:29][cH:30][c:31]([OH:33])[c:32]12>>[c:2]1([O:33][c:31]2[cH:30][cH:29][cH:28][c:27]3[cH:26][cH:25][n:24][cH:23][c:32]32)[n:3][cH:4][n:5][c:6]([N:8]2[CH2:9][CH2:10][N:11]([CH:14]([CH3:15])[c:16]3[cH:17][cH:18][c:19]([F:22])[cH:20][cH:21]3)[CH2:12][CH2:13]2)[cH:7]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-711be58caf06406abf562d67d3492e70
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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