ethyl 2-(1-(2-(4-fluorophenoxy)ethyl)-5-oxo-1H-1,2,4-triazol-4(5H)-yl)-4-methylthiazole-5-carboxylate → 2-(1-(2-(4-fluorophenoxy)ethyl)-5-oxo-1H-1,2,4-triazol-4(5H)-yl)-4-methylthiazole-5-carboxylic acid

HRID 88269Notes

Reaction equation

HRID 88269 reaction equation
[CH3:1][c:2]1[n:3][c:4](-[n:5]2[c:6](=[O:7])[n:8]([CH2:9][c:10]3[cH:11][cH:12][c:13]([C:14]([F:15])([F:16])[F:17])[cH:18][cH:19]3)[n:20][cH:21]2)[s:22][c:23]1[C:24]([O:25][CH2:26][CH3:27])=[O:28].[F:29][c:30]1[cH:31][cH:32][c:33]([O:34][CH2:35][CH2:36][n:37]2[n:38][cH:39][n:40](-[c:43]3[s:44][c:45]([C:49](=[O:50])[O:51][CH2:52][CH3:53])[c:46]([CH3:48])[n:47]3)[c:41]2=[O:42])[cH:54][cH:55]1>>[F:29][c:30]1[cH:31][cH:32][c:33]([O:34][CH2:35][CH2:36][n:37]2[n:38][cH:39][n:40](-[c:43]3[s:44][c:45]([C:49](=[O:50])[OH:51])[c:46]([CH3:48])[n:47]3)[c:41]2=[O:42])[cH:54][cH:55]1

Participants

3

Reactant 2

HCID 58031498ethyl 2-(1-(2-(4-fluorophenoxy)ethyl)-5-oxo-1H-1,2,4-triazol-4(5H)-yl)-4-methylthiazole-5-carboxylateHCID 58031587ethyl 4-methyl-2-(5-oxo-1-(4-(trifluoromethyl)benzyl)-1H-1,2,4-triazol-4(5H)-yl)thiazole-5-carboxylate

Product 1

HCID 580316322-(1-(2-(4-fluorophenoxy)ethyl)-5-oxo-1H-1,2,4-triazol-4(5H)-yl)-4-methylthiazole-5-carboxylic acid

Sources & evidence

ORD record
ord-c362d80aeebd420ebda62ef74b3b1990
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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