Water → 2,2-Dimethyl-3-(4-{2-[3-methyl-2-oxo-1-(4-trifluoromethyl-benzyl)-imidazolidin-4-yl]-ethoxy}-phenyl)-propionic acid methyl ester

HRID 316012Notes

Reaction equation

HRID 316012 reaction equation
[C:47](=[O:48])([O-:49])[O-:50].[CH3:16][N:17]1[C:18](=[O:46])[N:19]([CH2:35][c:36]2[cH:37][cH:38][c:39]([C:42]([F:43])([F:44])[F:45])[cH:40][cH:41]2)[CH2:20][CH:21]1[CH2:22][CH2:23][O:24][S:25]([c:26]1[cH:27][cH:28][c:29]([CH3:30])[cH:31][cH:32]1)(=[O:33])=[O:34].[CH3:1][O:2][C:3]([C:4]([CH2:5][c:6]1[cH:7][cH:8][c:9]([OH:12])[cH:10][cH:11]1)([CH3:13])[CH3:14])=[O:15].[Cs+:51].[Cs+:52].[O:53]=[CH:54][N:55]([CH3:56])[CH3:57].[OH2:58]>>[CH3:1][O:2][C:3]([C:4]([CH2:5][c:6]1[cH:7][cH:8][c:9]([O:12][CH2:23][CH2:22][CH:21]2[N:17]([CH3:16])[C:18](=[O:46])[N:19]([CH2:35][c:36]3[cH:37][cH:38][c:39]([C:42]([F:43])([F:44])[F:45])[cH:40][cH:41]3)[CH2:20]2)[cH:10][cH:11]1)([CH3:13])[CH3:14])=[O:15]

Participants

7

Reactant 6

HCID 962WaterHCID 6228DimethylformamideHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 53750180HCID 53750180, compoundHCID 86596229HCID 86596229, compound

Product 1

HCID 688672152,2-Dimethyl-3-(4-{2-[3-methyl-2-oxo-1-(4-trifluoromethyl-benzyl)-imidazolidin-4-yl]-ethoxy}-phenyl)-propionic acid methyl ester

Sources & evidence

ORD record
ord-559154e5761246cd9f3d49ee68c4379c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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