Potassium Cation → N-tert-butyl-2-{1-[4-(4-chloro-phenyl)-6-trifluoromethyl-pyrimidin-2-yl]-1H-imidazol-4-yl}-thiazole-5-sulfonamide

HRID 677877Notes

Reaction equation

HRID 677877 reaction equation
[C:36]([CH3:37])([CH3:38])([CH3:39])[NH:40][S:41](=[O:42])(=[O:43])[c:44]1[cH:45][n:46][c:47]([Cl:49])[s:48]1.[CH3:53][c:54]1[cH:55][cH:56][cH:57][cH:58][cH:59]1.[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][c:10](-[n:18]3[cH:19][n:20][c:21]([Sn:23]([CH2:24][CH2:25][CH2:26][CH3:27])([CH2:28][CH2:29][CH2:30][CH3:31])[CH2:32][CH2:33][CH2:34][CH3:35])[cH:22]3)[n:11][c:12]([C:14]([F:15])([F:16])[F:17])[cH:13]2)[cH:6][cH:7]1.[F-:50].[K+:51].[OH2:52]>>[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][c:10](-[n:18]3[cH:19][n:20][c:21](-[c:47]4[n:46][cH:45][c:44]([S:41]([NH:40][C:36]([CH3:37])([CH3:38])[CH3:39])(=[O:42])=[O:43])[s:48]4)[cH:22]3)[n:11][c:12]([C:14]([F:15])([F:16])[F:17])[cH:13]2)[cH:6][cH:7]1

Participants

7

Reactant 6

HCID 813Potassium CationHCID 962WaterHCID 1140TolueneHCID 28179Fluoride IonHCID 434557712-Chloro-thiazole-5-sulfonic acid tert-butylamideHCID 574688264-(4-Chloro-phenyl)-2-(4-tributylstannanyl-imidazol-1-yl)-6-trifluoromethyl-pyrimidine

Product 1

HCID 57468927N-tert-butyl-2-{1-[4-(4-chloro-phenyl)-6-trifluoromethyl-pyrimidin-2-yl]-1H-imidazol-4-yl}-thiazole-5-sulfonamide

Sources & evidence

ORD record
ord-52104859dd764c5dbd0b90ca51d1ef6f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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