Potassium Cation → 4-{2-[2-(4-Chloro-phenyl)-5,6-difluoro-benzoimidazol-1-yl]-2-cyclohexyl-ethylsulfanyl}-benzoic acid methyl ester

HRID 822851Notes

Reaction equation

HRID 822851 reaction equation
[C:12](=[O:13])([O-:14])[O-:15].[CH3:52][N:53]([CH3:54])[CH:55]=[O:56].[Cl:18][c:19]1[cH:20][cH:21][c:22](-[c:25]2[n:26][c:27]3[c:28]([n:29]2[CH:30]([CH2:31][O:32][c:33]2[cH:34][cH:35][cH:36][cH:37][c:38]2[F:39])[CH:40]2[CH2:41][CH2:42][CH2:43][CH2:44][CH2:45]2)[cH:46][c:47]([F:51])[c:48]([F:50])[cH:49]3)[cH:23][cH:24]1.[K+:16].[K+:17].[SH:1][c:2]1[cH:3][cH:4][c:5]([C:6](=[O:7])[O:8][CH3:9])[cH:10][cH:11]1>>[S:1]([c:2]1[cH:3][cH:4][c:5]([C:6](=[O:7])[O:8][CH3:9])[cH:10][cH:11]1)[CH2:31][CH:30]([n:29]1[c:25](-[c:22]2[cH:21][cH:20][c:19]([Cl:18])[cH:24][cH:23]2)[n:26][c:27]2[c:28]1[cH:46][c:47]([F:51])[c:48]([F:50])[cH:49]2)[CH:40]1[CH2:41][CH2:42][CH2:43][CH2:44][CH2:45]1

Participants

6

Reactant 5

HCID 813Potassium Cation2×HCID 6228DimethylformamideHCID 19660Carbonate IonHCID 237573Methyl 4-sulfanylbenzoateHCID 461844412-(4-Chloro-phenyl)-1-[1-cyclohexyl-2-(2-fluoro-phenoxy)-ethyl]-5,6-difluoro-1H-benzoimidazole

Product 1

HCID 666193434-{2-[2-(4-Chloro-phenyl)-5,6-difluoro-benzoimidazol-1-yl]-2-cyclohexyl-ethylsulfanyl}-benzoic acid methyl ester

Sources & evidence

ORD record
ord-cb40c52383d14b55942eb3ea4bf0851b
Source dataset
Test data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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