Dimethylformamide → (RS)-(5-cyano-2-{[2-ethoxy-2-(2-fluoro-4-methoxy-phenyl)-acetylamino]-methyl)-phenoxy)-acetic acid ethyl ester

HRID 185274Notes

Reaction equation

HRID 185274 reaction equation
[Br:32][CH2:33][C:34](=[O:35])[O:36][CH2:37][CH3:38].[C:1](#[N:2])[c:3]1[cH:4][c:5]([OH:26])[c:6]([CH2:7][NH:8][C:9]([CH:10]([c:11]2[c:12]([F:19])[cH:13][c:14]([O:17][CH3:18])[cH:15][cH:16]2)[O:20][CH2:21][CH3:22])=[O:23])[cH:24][cH:25]1.[C:27](=[O:28])([O-:29])[O-:30].[Cs+:31].[Cs+:39].[O:40]=[CH:41][N:42]([CH3:43])[CH3:44]>>[C:1](#[N:2])[c:3]1[cH:4][c:5]([O:26][CH2:33][C:34](=[O:35])[O:36][CH2:37][CH3:38])[c:6]([CH2:7][NH:8][C:9]([CH:10]([c:11]2[c:12]([F:19])[cH:13][c:14]([O:17][CH3:18])[cH:15][cH:16]2)[O:20][CH2:21][CH3:22])=[O:23])[cH:24][cH:25]1

Participants

6

Reactant 5

HCID 6228DimethylformamideHCID 7748Ethyl bromoacetateHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 21905309(RS)-N-(4-cyano-2-hydroxy-benzyl)-2-ethoxy-2-(2-fluoro-4-methoxy-phenyl)-acetamide

Product 1

HCID 69288832(RS)-(5-cyano-2-{[2-ethoxy-2-(2-fluoro-4-methoxy-phenyl)-acetylamino]-methyl)-phenoxy)-acetic acid ethyl ester

Sources & evidence

ORD record
ord-7b2f8b9ec5f645d0a4d59cf9baf43c7d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

Loading…