Hydrochloric Acid → 4-Acetyl-2-butyl-1-[(2'-carboxybiphenyl-4-yl)methyl]-5-cyanoimidazole

HRID 1205594Notes

Reaction equation

HRID 1205594 reaction equation
[C:1]([CH3:2])(=[O:3])[c:4]1[n:5][c:6]([CH2:31][CH2:32][CH2:33][CH3:34])[n:7]([CH2:11][c:12]2[cH:13][cH:14][c:15](-[c:18]3[c:19]([C:24](=[O:25])[O:26][C:27]([CH3:28])([CH3:29])[CH3:30])[cH:20][cH:21][cH:22][cH:23]3)[cH:16][cH:17]2)[c:8]1[C:9]#[N:10].[CH3:42][CH2:43][CH2:44][CH2:45][CH2:46][CH3:47].[ClH:35].[O:36]1[CH2:37][CH2:38][O:39][CH2:40][CH2:41]1>>[C:1]([CH3:2])(=[O:3])[c:4]1[n:5][c:6]([CH2:31][CH2:32][CH2:33][CH3:34])[n:7]([CH2:11][c:12]2[cH:13][cH:14][c:15](-[c:18]3[c:19]([C:24](=[O:25])[OH:26])[cH:20][cH:21][cH:22][cH:23]3)[cH:16][cH:17]2)[c:8]1[C:9]#[N:10]

Participants

5

Reactant 4

HCID 313Hydrochloric AcidHCID 8058HexaneHCID 312751,4-DioxaneHCID 190361124-Acetyl-1-[(2'-t-butoxycarbonylbiphenyl-4-yl)methyl]-2-butyl-5-cyanoimidazole

Product 1

HCID 190361394-Acetyl-2-butyl-1-[(2'-carboxybiphenyl-4-yl)methyl]-5-cyanoimidazole

Sources & evidence

ORD record
ord-bc3c19473a084bd5bedca499322b9508
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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