Potassium Cation → 4-(tert-butyl)-N-[3-(2-hydroxyethoxy)-1-methyl-4-phenyl-1H-pyrazol-5-yl]-N-[(2-methoxyethoxy)methyl]benzenesulfonamide

HRID 1214060Notes

Reaction equation

HRID 1214060 reaction equation
[C:1](=[O:2])([CH3:3])[O:4][CH2:5][CH2:6][O:7][c:8]1[n:9][n:10]([CH3:39])[c:11]([N:19]([CH2:20][O:21][CH2:22][CH2:23][O:24][CH3:25])[S:26](=[O:27])(=[O:28])[c:29]2[cH:30][cH:31][c:32]([C:35]([CH3:36])([CH3:37])[CH3:38])[cH:33][cH:34]2)[c:12]1-[c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1.[C:40](=[O:41])([O-:42])[O-:43].[CH3:46][OH:47].[K+:44].[K+:45].[OH2:48]>>[OH:4][CH2:5][CH2:6][O:7][c:8]1[n:9][n:10]([CH3:39])[c:11]([N:19]([CH2:20][O:21][CH2:22][CH2:23][O:24][CH3:25])[S:26](=[O:27])(=[O:28])[c:29]2[cH:30][cH:31][c:32]([C:35]([CH3:36])([CH3:37])[CH3:38])[cH:33][cH:34]2)[c:12]1-[c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1

Participants

6

Reactant 5

HCID 813Potassium Cation2×HCID 887MethanolHCID 962WaterHCID 19660Carbonate IonHCID 222820392-[(5-{{[4-(tert-butyl)phenyl]sulfonyl}[(2-methoxyethoxy)methyl]amino}-1-methyl-4-phenyl-1H-pyrazol-3-yl)oxy]ethyl acetate

Product 1

HCID 222820064-(tert-butyl)-N-[3-(2-hydroxyethoxy)-1-methyl-4-phenyl-1H-pyrazol-5-yl]-N-[(2-methoxyethoxy)methyl]benzenesulfonamide

Sources & evidence

ORD record
ord-11abf57de01f431d989709a9d1ec46b0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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