Ethanol → HCID 19036248, compound

HRID 320325Notes

Reaction equation

HRID 320325 reaction equation
[BH4-:1].[CH2:3]([CH2:4][CH3:5])[c:6]1[n:7]([CH2:19][c:20]2[cH:21][cH:22][c:23](-[c:26]3[c:27](-[c:32]4[n:33][n:34][n:35][n:36]4[C:37]([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)[c:50]4[cH:51][cH:52][cH:53][cH:54][cH:55]4)[cH:28][cH:29][cH:30][cH:31]3)[cH:24][cH:25]2)[c:8]([C:17]#[N:18])[c:9]([C:11]([C:12]([CH3:13])([CH3:14])[CH3:15])=[O:16])[n:10]1.[CH3:56][CH2:57][OH:58].[Na+:2].[O:59]1[CH2:60][CH2:61][CH2:62][CH2:63]1>>[CH2:3]([CH2:4][CH3:5])[c:6]1[n:7]([CH2:19][c:20]2[cH:21][cH:22][c:23](-[c:26]3[c:27](-[c:32]4[n:33][n:34][n:35][n:36]4[C:37]([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)[c:50]4[cH:51][cH:52][cH:53][cH:54][cH:55]4)[cH:28][cH:29][cH:30][cH:31]3)[cH:24][cH:25]2)[c:8]([C:17]#[N:18])[c:9]([CH:11]([C:12]([CH3:13])([CH3:14])[CH3:15])[OH:16])[n:10]1

Participants

6

Reactant 5

HCID 702EthanolHCID 923Sodium ionHCID 8028TetrahydrofuranHCID 28123BorohydrideHCID 217408232-Propyl-4-pivaloyl-1-{4-[2-(trityltetrazol-5-yl)phenyl]phenyl}methylimidazole-5-carbonitrile

Product 1

HCID 19036248HCID 19036248, compound

Sources & evidence

ORD record
ord-3fbc5145d83549f1893d6d8dd096dd0f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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