Potassium Cation → 2-methyl-1-[3-methyl-5-(tetrahydro-2H-thiopyran-4-yloxy)-1-benzofuran-2-yl]propan-1-one

HRID 122156

Reaction equation

HRID 122156 reaction equation
[CH3:17][c:18]1[cH:19][cH:20][c:21]([S:22]([O:23][CH:28]2[CH2:29][CH2:30][S:31][CH2:32][CH2:33]2)(=[O:24])=[O:25])[cH:26][cH:27]1.[CH3:43][N:44]([CH3:45])[CH:46]=[O:47].[K+:39].[K+:40].[K+:41].[OH2:42].[OH:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([c:7]([CH3:15])[c:8]([C:10]([CH:11]([CH3:12])[CH3:13])=[O:14])[o:9]2)[cH:16]1.[P:34]([O-:35])([O-:36])([O-:37])=[O:38]>>[O:1]([c:2]1[cH:3][cH:4][c:5]2[c:6]([c:7]([CH3:15])[c:8]([C:10]([CH:11]([CH3:12])[CH3:13])=[O:14])[o:9]2)[cH:16]1)[CH:28]1[CH2:29][CH2:30][S:31][CH2:32][CH2:33]1

Participants

7

Reactant 6

HCID 813Potassium Cation3×HCID 962WaterHCID 1061PhosphateHCID 6228DimethylformamideHCID 270400Tetrahydro-2h-thiopyran-4-yl 4-methylbenzenesulfonateHCID 667785551-(5-Hydroxy-3-methyl-1-benzofuran-2-yl)-2-methylpropan-1-one

Product 1

HCID 667778112-methyl-1-[3-methyl-5-(tetrahydro-2H-thiopyran-4-yloxy)-1-benzofuran-2-yl]propan-1-one

Sources & evidence

ORD record
ord-5112632449624fc2ab8f070eb86a3105
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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