2-(1-oxo-3,4,5,6,7,8-hexahydrobenzothieno[2,3-c]pyridin-2(1H)-yl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl Acetate → [2-(5-{[5-(Methoxymethyl)-1-methyl-1H-pyrazol-3-yl]amino}-1-methyl-6-oxo-1,6-dihydropyridin-3-yl)-6-{6-oxo-8-thia-5-azatricyclo[7.4.0.02,7]-trideca-1(9),2(7)-dien-5-yl}phenyl]methyl Acetate
Reaction equation
[Br:1][c:2]1[cH:3][c:4]([NH:10][c:11]2[n:12][n:13]([CH3:19])[c:14]([CH2:16][O:17][CH3:18])[cH:15]2)[c:5](=[O:9])[n:6]([CH3:8])[cH:7]1.[C:20]([CH3:21])(=[O:22])[O:23][CH2:24][c:25]1[c:26]([N:40]2[C:41](=[O:53])[c:42]3[c:43]([c:46]4[c:47]([s:48]3)[CH2:49][CH2:50][CH2:51][CH2:52]4)[CH2:44][CH2:45]2)[cH:27][cH:28][cH:29][c:30]1[B:31]1[O:32][C:33]([CH3:34])([CH3:35])[C:36]([CH3:37])([CH3:38])[O:39]1>>[c:2]1(-[c:30]2[c:25]([CH2:24][O:23][C:20]([CH3:21])=[O:22])[c:26]([N:40]3[C:41](=[O:53])[c:42]4[c:43]([c:46]5[c:47]([s:48]4)[CH2:49][CH2:50][CH2:51][CH2:52]5)[CH2:44][CH2:45]3)[cH:27][cH:28][cH:29]2)[cH:3][c:4]([NH:10][c:11]2[n:12][n:13]([CH3:19])[c:14]([CH2:16][O:17][CH3:18])[cH:15]2)[c:5](=[O:9])[n:6]([CH3:8])[cH:7]1Participants
3
Reactant 2
Product 1
Sources & evidence
- ORD record
- ord-6e1af9d8a07b420681470804ce2e2cab
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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