Acetate → 5-(1H-Imidazol-2-yl)-4'-methyl-biphenyl-3-carboxylic acid (2-methoxy-1-methyl-ethyl)-amide

HRID 209397Notes

Reaction equation

HRID 209397 reaction equation
[CH3:30][O:31][CH2:32][CH:33]([CH3:34])[NH:35][C:36](=[O:37])[c:38]1[cH:39][c:40](-[c:45]2[cH:46][cH:47][c:48]([CH3:51])[cH:49][cH:50]2)[cH:41][c:42]([I:44])[cH:43]1.[Cu:59][I:60].[O-:62][C:63]([CH3:64])=[O:65].[O-:66][C:67]([CH3:68])=[O:69].[O:52]1[CH2:53][CH2:54][O:55][CH2:56][CH2:57]1.[O:6]=[CH:7][N:8]([CH3:9])[CH3:10].[OH2:58].[Pd+2:61].[c:11]1([P:12]([c:13]2[cH:14][cH:15][cH:16][cH:17][cH:18]2)[c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[cH:25][cH:26][cH:27][cH:28][cH:29]1.[nH:1]1[cH:2][n:3][cH:4][cH:5]1>>[nH:1]1[c:2](-[c:42]2[cH:41][c:40](-[c:45]3[cH:46][cH:47][c:48]([CH3:51])[cH:49][cH:50]3)[cH:39][c:38]([C:36]([NH:35][CH:33]([CH2:32][O:31][CH3:30])[CH3:34])=[O:37])[cH:43]2)[n:3][cH:4][cH:5]1

Participants

10

Reactant 9

HCID 175Acetate2×HCID 795ImidazoleHCID 962WaterHCID 6228DimethylformamideHCID 11776TriphenylphosphineHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 312751,4-DioxaneHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 594325375-Iodo-4'-methyl-biphenyl-3-carboxylic acid (2-methoxy-1-methyl-ethyl)-amide

Product 1

HCID 577497765-(1H-Imidazol-2-yl)-4'-methyl-biphenyl-3-carboxylic acid (2-methoxy-1-methyl-ethyl)-amide

Sources & evidence

ORD record
ord-56e111f42cdb469ba9d152a969e4ff5a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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