Sodium ion → 4-(1-Hydroxy-2-methylpropyl)-2-propyl-1-{4-[2-(trityltetrazol-5-yl)phenyl]phenyl}methylimidazole-5-carbonitrile
Reaction equation
[BH4-:53].[C:1]([CH:2]([CH3:3])[CH3:4])(=[O:5])[c:6]1[n:7][c:8]([CH2:50][CH2:51][CH3:52])[n:9]([CH2:13][c:14]2[cH:15][cH:16][c:17](-[c:20]3[c:21](-[c:26]4[n:27][n:28][n:29][n:30]4[C:31]([c:32]4[cH:33][cH:34][cH:35][cH:36][cH:37]4)([c:38]4[cH:39][cH:40][cH:41][cH:42][cH:43]4)[c:44]4[cH:45][cH:46][cH:47][cH:48][cH:49]4)[cH:22][cH:23][cH:24][cH:25]3)[cH:18][cH:19]2)[c:10]1[C:11]#[N:12].[Na+:54]>>[CH:1]([CH:2]([CH3:3])[CH3:4])([OH:5])[c:6]1[n:7][c:8]([CH2:50][CH2:51][CH3:52])[n:9]([CH2:13][c:14]2[cH:15][cH:16][c:17](-[c:20]3[c:21](-[c:26]4[n:27][n:28][n:29][n:30]4[C:31]([c:32]4[cH:33][cH:34][cH:35][cH:36][cH:37]4)([c:38]4[cH:39][cH:40][cH:41][cH:42][cH:43]4)[c:44]4[cH:45][cH:46][cH:47][cH:48][cH:49]4)[cH:22][cH:23][cH:24][cH:25]3)[cH:18][cH:19]2)[c:10]1[C:11]#[N:12]Participants
4
Sources & evidence
- ORD record
- ord-d8887bc7d08143ad9df578b7f2ea598f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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