Sodium ion → (4,4-difluoropiperidin-1-yl)(1-(4-fluorophenylsulfonyl)-5-(1-isopropylpiperidin-4-yloxy)-1H-indol-2-yl)methanone

HRID 178736Notes

Reaction equation

HRID 178736 reaction equation
[CH3:43][N:44]([CH3:45])[CH:46]=[O:47].[F:32][c:33]1[cH:34][cH:35][c:36]([S:39](=[O:40])(=[O:41])[Cl:42])[cH:37][cH:38]1.[F:3][C:4]1([F:31])[CH2:5][CH2:6][N:7]([C:10](=[O:11])[c:12]2[nH:13][c:14]3[cH:15][cH:16][c:17]([O:21][CH:22]4[CH2:23][CH2:24][N:25]([CH:28]([CH3:29])[CH3:30])[CH2:26][CH2:27]4)[cH:18][c:19]3[cH:20]2)[CH2:8][CH2:9]1.[H-:1].[Na+:2]>>[F:3][C:4]1([F:31])[CH2:5][CH2:6][N:7]([C:10](=[O:11])[c:12]2[n:13]([S:39]([c:36]3[cH:35][cH:34][c:33]([F:32])[cH:38][cH:37]3)(=[O:40])=[O:41])[c:14]3[cH:15][cH:16][c:17]([O:21][CH:22]4[CH2:23][CH2:24][N:25]([CH:28]([CH3:29])[CH3:30])[CH2:26][CH2:27]4)[cH:18][c:19]3[cH:20]2)[CH2:8][CH2:9]1

Participants

6

Reactant 5

HCID 923Sodium ionHCID 6228DimethylformamideHCID 95884-Fluorobenzenesulfonyl chlorideHCID 166653HydrideHCID 11603838(4,4-Difluoropiperidin-1-yl)[5-(1-isopropyl-piperidin-4-yloxy)-1H-indol-2-yl]methanone

Product 1

HCID 16739387(4,4-difluoropiperidin-1-yl)(1-(4-fluorophenylsulfonyl)-5-(1-isopropylpiperidin-4-yloxy)-1H-indol-2-yl)methanone

Sources & evidence

ORD record
ord-f2c9fa3474014bab9c240e763e192f4d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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