Formic Acid → 2-(1-Isopropyl-piperidin-4-ylcarbamoyl)-1-(3-methoxy-benzyl)-1H-benzoimidazole-5-carboxylic acid methyl ester

HRID 2321558Notes

Reaction equation

HRID 2321558 reaction equation
[Br:26][CH2:27][c:28]1[cH:29][c:30]([O:34][CH3:35])[cH:31][cH:32][cH:33]1.[CH3:1][O:2][C:3](=[O:4])[c:5]1[cH:6][c:7]2[c:8]([nH:9][c:10]([C:12]([NH:13][CH:14]3[CH2:15][CH2:16][N:17]([CH:20]([CH3:21])[CH3:22])[CH2:18][CH2:19]3)=[O:23])[n:11]2)[cH:24][cH:25]1.[CH3:36][C:37]#[N:38].[CH:40]([OH:41])=[O:42].[OH2:39]>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[cH:6][c:7]2[c:8]([n:9]([CH2:27][c:28]3[cH:29][c:30]([O:34][CH3:35])[cH:31][cH:32][cH:33]3)[c:10]([C:12]([NH:13][CH:14]3[CH2:15][CH2:16][N:17]([CH:20]([CH3:21])[CH3:22])[CH2:18][CH2:19]3)=[O:23])[n:11]2)[cH:24][cH:25]1

Participants

6

Reactant 5

HCID 284Formic AcidHCID 962WaterHCID 6342AcetonitrileHCID 40672073-Methoxybenzyl bromideHCID 178497373HCID 178497373, compound

Product 1

HCID 670125852-(1-Isopropyl-piperidin-4-ylcarbamoyl)-1-(3-methoxy-benzyl)-1H-benzoimidazole-5-carboxylic acid methyl ester

Sources & evidence

ORD record
ord-d8191c5a79bb4139bc9c17d8b64d9cf0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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