2-(3-Bromophenyl)-4-(3-methyl-4-trifluoromethyl-phenyl)-6-trifluoromethyl-pyrimidine → N-tert-Butyl-5-{3-[6-(3-methyl-4-trifluoromethyl-phenyl)-4-trifluoromethyl-pyrimidin-2-yl]-phenyl}-thiophene-2-sulfonic acid amide

HRID 104975Notes

Reaction equation

HRID 104975 reaction equation
[Br:1][c:2]1[cH:3][c:4](-[c:8]2[n:9][c:10]([C:25]([F:26])([F:27])[F:28])[cH:11][c:12](-[c:14]3[cH:15][c:16]([CH3:24])[c:17]([C:20]([F:21])([F:22])[F:23])[cH:18][cH:19]3)[n:13]2)[cH:5][cH:6][cH:7]1.[C:29]([CH3:30])([CH3:31])([CH3:32])[NH:33][S:34](=[O:35])(=[O:36])[c:37]1[s:38][c:39]([B:42]2[O:43][C:44]([CH3:45])([CH3:46])[C:47]([CH3:48])([CH3:49])[O:50]2)[cH:40][cH:41]1>>[c:2]1(-[c:39]2[s:38][c:37]([S:34]([NH:33][C:29]([CH3:30])([CH3:31])[CH3:32])(=[O:35])=[O:36])[cH:41][cH:40]2)[cH:3][c:4](-[c:8]2[n:9][c:10]([C:25]([F:26])([F:27])[F:28])[cH:11][c:12](-[c:14]3[cH:15][c:16]([CH3:24])[c:17]([C:20]([F:21])([F:22])[F:23])[cH:18][cH:19]3)[n:13]2)[cH:5][cH:6][cH:7]1

Participants

3

Reactant 2

HCID 574687662-(3-Bromophenyl)-4-(3-methyl-4-trifluoromethyl-phenyl)-6-trifluoromethyl-pyrimidineHCID 57468817N-tert-butyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)thiophene-2-sulfonamide

Product 1

HCID 57468972N-tert-Butyl-5-{3-[6-(3-methyl-4-trifluoromethyl-phenyl)-4-trifluoromethyl-pyrimidin-2-yl]-phenyl}-thiophene-2-sulfonic acid amide

Sources & evidence

ORD record
ord-fc3e14601c854951b59ebe67097b91b8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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