Bromide ion → 2-(5-(4-Amino-6-methyl-1,3,5-triazin-2-YL)-6-(5-(phenylsulfonyl)pyridin-3-ylamino)pyridin-3-YL)propan-2-OL
Reaction equation
[Br-:5].[CH2:41]1[O:42][CH2:43][CH2:44][CH2:45]1.[CH3:46][CH2:47][O:48][C:49]([CH3:50])=[O:51].[CH3:6][Mg+:7].[Cl:1][Ce:2]([Cl:3])[Cl:4].[NH2:8][c:9]1[n:10][c:11](-[c:16]2[cH:17][c:18]([C:38]([CH3:39])=[O:40])[cH:19][n:20][c:21]2[NH:22][c:23]2[cH:24][n:25][cH:26][c:27]([S:29](=[O:30])(=[O:31])[c:32]3[cH:33][cH:34][cH:35][cH:36][cH:37]3)[cH:28]2)[n:12][c:13]([CH3:15])[n:14]1>>[CH3:6][C:38]([c:18]1[cH:17][c:16](-[c:11]2[n:10][c:9]([NH2:8])[n:14][c:13]([CH3:15])[n:12]2)[c:21]([NH:22][c:23]2[cH:24][n:25][cH:26][c:27]([S:29](=[O:30])(=[O:31])[c:32]3[cH:33][cH:34][cH:35][cH:36][cH:37]3)[cH:28]2)[n:20][cH:19]1)([CH3:39])[OH:40]Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-b1c8ef35ba3d43f6b721722df5d912bd
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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