Bicarbonate Ion → Ethyl 1-((2'-cyano(1,1'-biphenyl)-4-yl)methyl)-4-(1-hydroxy-1-methylethyl)-2-propyl-1H-imidazole-5-carboxylate

HRID 2322168Notes

Reaction equation

HRID 2322168 reaction equation
[C:7]([CH3:9])([CH3:10])([NH:11][C:12](=[O:8])[c:14]1[c:15](-[c:20]2[cH:21][cH:22][c:23]([CH2:26][n:27]3[c:28]([CH2:41][CH2:42][CH3:43])[n:29][c:30]([C:37]([CH3:38])([CH3:39])[OH:40])[c:31]3[C:32](=[O:33])[O:34][CH2:35][CH3:36])[cH:24][cH:25]2)[cH:16][cH:17][cH:18][cH:19]1)[CH3:13].[CH2:44]([Cl:45])[Cl:46].[CH3:52][CH2:53][O:54][C:55](=[O:56])[CH3:57].[Cl:1][C:2]([C:3]([Cl:4])=[O:5])=[O:6].[Na+:47].[OH:48][C:49](=[O:50])[O-:51]>>[N:11]#[C:12][c:14]1[c:15](-[c:20]2[cH:21][cH:22][c:23]([CH2:26][n:27]3[c:28]([CH2:41][CH2:42][CH3:43])[n:29][c:30]([C:37]([CH3:38])([CH3:39])[OH:40])[c:31]3[C:32](=[O:33])[O:34][CH2:35][CH3:36])[cH:24][cH:25]2)[cH:16][cH:17][cH:18][cH:19]1

Participants

7

Reactant 6

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 6344DichloromethaneHCID 8857Ethyl AcetateHCID 65578Oxalyl chlorideHCID 19036152Ethyl 1-{4-[2-(t-butylaminocarbonyl)phenyl]phenyl}methyl-4-(1-hydroxy-1-methylethyl)-2-propylimidazole-5-carboxylate

Product 1

HCID 15461993Ethyl 1-((2'-cyano(1,1'-biphenyl)-4-yl)methyl)-4-(1-hydroxy-1-methylethyl)-2-propyl-1H-imidazole-5-carboxylate

Sources & evidence

ORD record
ord-959dbd8cdfd643d19744d23b7a0a3b2d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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