4-Bromo-2-(1,1-dioxoisothiazolidin-2-yl)benzoic acid → [4-Bromo-2-(1,1-dioxoisothiazolidin-2-yl)phenyl][4-(5-ethyl-3-methylpyridin-2-yl)piperazin-1-yl]methanone
Reaction equation
[Br:1][c:2]1[cH:3][c:4]([N:11]2[S:12](=[O:16])(=[O:17])[CH2:13][CH2:14][CH2:15]2)[c:5]([C:6](=[O:7])[OH:8])[cH:9][cH:10]1.[CH2:18]([CH3:19])[c:20]1[cH:21][c:22]([CH3:32])[c:23]([N:26]2[CH2:27][CH2:28][NH:29][CH2:30][CH2:31]2)[n:24][cH:25]1>>[Br:1][c:2]1[cH:3][c:4]([N:11]2[S:12](=[O:16])(=[O:17])[CH2:13][CH2:14][CH2:15]2)[c:5]([C:6](=[O:8])[N:29]2[CH2:28][CH2:27][N:26]([c:23]3[c:22]([CH3:32])[cH:21][c:20]([CH2:18][CH3:19])[cH:25][n:24]3)[CH2:31][CH2:30]2)[cH:9][cH:10]1Participants
3
Sources & evidence
- ORD record
- ord-037733ac2df84275b53f025f60117915
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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