Potassium Cation → N-{2-fluoro-3-[hydroxy-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)-methyl]-phenyl}-4-trifluoromethyl-benzenesulfonamide

HRID 2161901Notes

Reaction equation

HRID 2161901 reaction equation
[CH3:36][OH:37].[F:1][c:2]1[c:3]([NH:10][S:11](=[O:12])(=[O:13])[c:14]2[cH:15][cH:16][c:17]([C:20]([F:21])([F:22])[F:23])[cH:18][cH:19]2)[cH:4][cH:5][cH:6][c:7]1[CH:8]=[O:9].[K+:34].[OH-:33].[OH2:35].[n:24]1[cH:25][n:26][cH:27][c:28]2[c:29]1[nH:30][cH:31][cH:32]2>>[F:1][c:2]1[c:3]([NH:10][S:11](=[O:12])(=[O:13])[c:14]2[cH:15][cH:16][c:17]([C:20]([F:21])([F:22])[F:23])[cH:18][cH:19]2)[cH:4][cH:5][cH:6][c:7]1[CH:8]([OH:9])[c:32]1[c:28]2[cH:27][n:26][cH:25][n:24][c:29]2[nH:30][cH:31]1

Participants

7

Reactant 6

HCID 813Potassium CationHCID 887MethanolHCID 961HydroxideHCID 962WaterHCID 2615917H-Pyrrolo(2,3-d)pyrimidineHCID 57963257N-(2-fluoro-3-formyl-phenyl)-4-trifluoromethyl-benzenesulfonamide

Product 1

HCID 57963304N-{2-fluoro-3-[hydroxy-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)-methyl]-phenyl}-4-trifluoromethyl-benzenesulfonamide

Sources & evidence

ORD record
ord-0a0312e378024e78a2aaec80cc04195c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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