Acetone → (1-{2-[5-(4-Bromo-phenyl)-1H-imidazol-2-yl]-4-oxo-pyrrolidine-1-carbonyl}-2-methyl-propyl)-carbamic acid methyl ester

HRID 1226515Notes

Reaction equation

HRID 1226515 reaction equation
[CH3:1][O:2][C:3]([NH:4][CH:5]([CH:6]([CH3:7])[CH3:8])[C:9](=[O:10])[N:11]1[CH2:12][C:13]2([O:14][CH2:17][CH2:16][O:15]2)[CH2:18][CH:19]1[c:20]1[nH:21][c:22](-[c:25]2[cH:26][cH:27][c:28]([Br:31])[cH:29][cH:30]2)[cH:23][n:24]1)=[O:32].[CH3:34][C:35](=[O:36])[CH3:37].[OH2:33]>>[CH3:1][O:2][C:3]([NH:4][CH:5]([CH:6]([CH3:7])[CH3:8])[C:9](=[O:10])[N:11]1[CH2:12][C:13](=[O:14])[CH2:18][CH:19]1[c:20]1[nH:21][c:22](-[c:25]2[cH:26][cH:27][c:28]([Br:31])[cH:29][cH:30]2)[cH:23][n:24]1)=[O:32]

Participants

4

Reactant 3

HCID 180AcetoneHCID 962WaterHCID 66621245(1-{8-[5-(4-Bromo-phenyl)-1H-imidazol-2-yl]-1,4-dioxa-7-aza-spiro[4.4]nonane-7-carbonyl]-2-methyl-propyl)-carbamic acid methyl ester

Product 1

HCID 66620390(1-{2-[5-(4-Bromo-phenyl)-1H-imidazol-2-yl]-4-oxo-pyrrolidine-1-carbonyl}-2-methyl-propyl)-carbamic acid methyl ester

Sources & evidence

ORD record
ord-b6386a5c9c8c484eac98b70f6f5133d2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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