Potassium Cation → 5-cyclopropyl-2-[4-(4-fluorophenoxy)phenyl]-6-[(2-hydroxyethyl)-(methylsulfonyl)amino]-N-methyl-2H-indazole-3-carboxamide

HRID 291881Notes

Reaction equation

HRID 291881 reaction equation
[Br:42][CH2:43][CH2:44][OH:45].[C:36](=[O:37])([O-:38])[O-:39].[CH3:46][CH2:47][O:48][C:49]([CH3:50])=[O:51].[CH:1]1([c:4]2[cH:5][c:6]3[c:7]([C:32](=[O:33])[NH:34][CH3:35])[n:8](-[c:18]4[cH:19][cH:20][c:21]([O:24][c:25]5[cH:26][cH:27][c:28]([F:31])[cH:29][cH:30]5)[cH:22][cH:23]4)[n:9][c:10]3[cH:11][c:12]2[NH:13][S:14](=[O:15])(=[O:16])[CH3:17])[CH2:2][CH2:3]1.[K+:40].[K+:41]>>[CH:1]1([c:4]2[cH:5][c:6]3[c:7]([C:32](=[O:33])[NH:34][CH3:35])[n:8](-[c:18]4[cH:19][cH:20][c:21]([O:24][c:25]5[cH:26][cH:27][c:28]([F:31])[cH:29][cH:30]5)[cH:22][cH:23]4)[n:9][c:10]3[cH:11][c:12]2[N:13]([S:14](=[O:15])(=[O:16])[CH3:17])[CH2:43][CH2:44][OH:45])[CH2:2][CH2:3]1

Participants

6

Reactant 5

HCID 813Potassium Cation2×HCID 8857Ethyl AcetateHCID 108982-BromoethanolHCID 19660Carbonate IonHCID 569626885-cyclopropyl-2-[4-(4-fluorophenoxy)phenyl]-N-methyl-6-[(methylsulfonyl)amino]-2H-indazole-3-carboxamide

Product 1

HCID 569627685-cyclopropyl-2-[4-(4-fluorophenoxy)phenyl]-6-[(2-hydroxyethyl)-(methylsulfonyl)amino]-N-methyl-2H-indazole-3-carboxamide

Sources & evidence

ORD record
ord-7ff2eb2f183e4b2e8787c0a95e957f7c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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