Sodium ion → 2-Phenyl-ethanesulfonic acid {5-p-tolyl-6-[2-(5-trifluoromethyl-pyridin-2-yloxy)-ethoxy]-pyrimidin-4-yl}-amide

HRID 1541025Notes

Reaction equation

HRID 1541025 reaction equation
[CH2:43]1[O:44][CH2:45][CH2:46][CH2:47]1.[Cl:32][c:33]1[n:34][cH:35][c:36]([C:39]([F:40])([F:41])[F:42])[cH:37][cH:38]1.[H-:1].[Na+:2].[OH:3][CH2:4][CH2:5][O:6][c:7]1[c:8](-[c:25]2[cH:26][cH:27][c:28]([CH3:31])[cH:29][cH:30]2)[c:9]([NH:13][S:14](=[O:15])(=[O:16])[CH2:17][CH2:18][c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[n:10][cH:11][n:12]1>>[O:3]([CH2:4][CH2:5][O:6][c:7]1[c:8](-[c:25]2[cH:26][cH:27][c:28]([CH3:31])[cH:29][cH:30]2)[c:9]([NH:13][S:14](=[O:15])(=[O:16])[CH2:17][CH2:18][c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[n:10][cH:11][n:12]1)[c:33]1[n:34][cH:35][c:36]([C:39]([F:40])([F:41])[F:42])[cH:37][cH:38]1

Participants

6

Reactant 5

HCID 923Sodium ionHCID 8028TetrahydrofuranHCID 923422-Chloro-5-(trifluoromethyl)pyridineHCID 166653HydrideHCID 235482692-Phenyl-ethanesulfonic acid [6-(2-hydroxy-ethoxy)-5-p-tolyl-pyrimidin-4-yl]-amide

Product 1

HCID 235482452-Phenyl-ethanesulfonic acid {5-p-tolyl-6-[2-(5-trifluoromethyl-pyridin-2-yloxy)-ethoxy]-pyrimidin-4-yl}-amide

Sources & evidence

ORD record
ord-03822b9ea2394290b05d9b50f45b89a6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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