Bicarbonate Ion → 2-(3-Thienyl)-6-methyl-4-(1-methyl-3-trifluoromethyl-5-pyrazolyloxy)-pyrimidine
Reaction equation
[C:58](=[O:59])([O-:60])[OH:61].[CH3:70][c:71]1[cH:72][cH:73][cH:74][cH:75][cH:76]1.[Cl:31][c:32]1[n:33][c:34]([CH3:49])[cH:35][c:36]([O:38][c:39]2[cH:40][c:41]([C:45]([F:46])([F:47])[F:48])[n:42][n:43]2[CH3:44])[n:37]1.[Na+:62].[O:63]1[CH2:64][CH2:65][O:66][CH2:67][CH2:68]1.[OH2:69].[c:1]1([P:2]([c:3]2[cH:4][cH:5][cH:6][cH:7][cH:8]2)[CH2:9][CH2:10][CH2:11][CH2:12][P:13]([c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[cH:26][cH:27][cH:28][cH:29][cH:30]1.[s:50]1[cH:51][c:52]([B:55]([OH:56])[OH:57])[cH:53][cH:54]1>>[c:32]1(-[c:52]2[cH:51][s:50][cH:54][cH:53]2)[n:33][c:34]([CH3:49])[cH:35][c:36]([O:38][c:39]2[cH:40][c:41]([C:45]([F:46])([F:47])[F:48])[n:42][n:43]2[CH3:44])[n:37]1Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-0bcc81081bf54cbcbdc289dab00a5f24
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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