Bromide ion → 2-[(4-Acetyl-3-hydroxy-2-propylbenzyl)thio]-4-hydroxypyrimidine
Reaction equation
[Br-:32].[C:1]([CH3:2])(=[O:3])[c:4]1[c:5]([OH:15])[c:6]([CH2:12][CH2:13][CH3:14])[c:7]([CH2:8][Cl:9])[cH:10][cH:11]1.[C:24](=[O:25])([O-:26])[O-:27].[CH2:33]([N+:34]([CH2:35][CH2:36][CH2:37][CH3:38])([CH2:39][CH2:40][CH2:41][CH3:42])[CH2:43][CH2:44][CH2:45][CH3:46])[CH2:47][CH2:48][CH3:49].[CH2:56]([C:57]([CH3:58])=[O:59])[CH3:60].[CH3:50][CH2:51][O:52][C:53](=[O:54])[CH3:55].[K+:28].[K+:29].[Na+:31].[OH-:30].[OH:16][c:17]1[n:18][c:19]([SH:23])[n:20][cH:21][cH:22]1>>[C:1]([CH3:2])(=[O:3])[c:4]1[c:5]([OH:15])[c:6]([CH2:12][CH2:13][CH3:14])[c:7]([CH2:8][S:23][c:19]2[n:18][c:17]([OH:16])[cH:22][cH:21][n:20]2)[cH:10][cH:11]1Participants
11
Reactant 10
Product 1
Sources & evidence
- ORD record
- ord-9234c297ae9f42c7b5c4680ff7fc7be1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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