Potassium Cation → 6-[[6-(Acetylamino)-pyrimidin-4-yl]oxy]-naphthalene-1-carboxylic acid [3-(4-methyl-imidazol-1-yl)-5-trifluoromethyl-phenyl]-amide

HRID 90162Notes

Reaction equation

HRID 90162 reaction equation
[CH3:50][c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1.[Cl:39][c:40]1[cH:41][c:42]([NH:46][C:47]([CH3:48])=[O:49])[n:43][cH:44][n:45]1.[K+:6].[K+:7].[K+:8].[OH:9][c:10]1[cH:11][c:12]2[cH:13][cH:14][cH:15][c:16]([C:20](=[O:21])[NH:22][c:23]3[cH:24][c:25](-[n:33]4[cH:34][n:35][c:36]([CH3:38])[cH:37]4)[cH:26][c:27]([C:29]([F:30])([F:31])[F:32])[cH:28]3)[c:17]2[cH:18][cH:19]1.[P:1]([O-:2])([O-:3])([O-:4])=[O:5]>>[O:9]([c:10]1[cH:11][c:12]2[cH:13][cH:14][cH:15][c:16]([C:20](=[O:21])[NH:22][c:23]3[cH:24][c:25](-[n:33]4[cH:34][n:35][c:36]([CH3:38])[cH:37]4)[cH:26][c:27]([C:29]([F:30])([F:31])[F:32])[cH:28]3)[c:17]2[cH:18][cH:19]1)[c:40]1[cH:41][c:42]([NH:46][C:47]([CH3:48])=[O:49])[n:43][cH:44][n:45]1

Participants

6

Reactant 5

HCID 813Potassium Cation3×HCID 1061PhosphateHCID 1140TolueneHCID 539477N-(6-chloropyrimidin-4-yl)acetamideHCID 68591664HCID 68591664, compound

Product 1

HCID 251573116-[[6-(Acetylamino)-pyrimidin-4-yl]oxy]-naphthalene-1-carboxylic acid [3-(4-methyl-imidazol-1-yl)-5-trifluoromethyl-phenyl]-amide

Sources & evidence

ORD record
ord-bad6c6011f2448caa8abc68ca7e65ba6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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