Bicarbonate Ion → 4-[4-({3-chloro-4-[3-(trifluoromethyl)phenoxy]phenyl}amino)-5H-pyrrolo[3,2-d]pyrimidin-5-yl]butyl acetate
Reaction equation
[C:1]([CH3:2])(=[O:3])[O:4][CH2:5][CH2:6][CH2:7][CH2:8][n:9]1[cH:10][cH:11][c:12]2[n:13][cH:14][n:15][c:16]([Cl:18])[c:17]12.[C:38](=[O:39])([O-:40])[OH:41].[CH:43]([OH:44])([CH3:45])[CH3:46].[Cl:19][c:20]1[cH:21][c:22]([NH2:23])[cH:24][cH:25][c:26]1[O:27][c:28]1[cH:29][c:30]([C:34]([F:35])([F:36])[F:37])[cH:31][cH:32][cH:33]1.[Na+:42]>>[C:1]([CH3:2])(=[O:3])[O:4][CH2:5][CH2:6][CH2:7][CH2:8][n:9]1[cH:10][cH:11][c:12]2[n:13][cH:14][n:15][c:16]([NH:23][c:22]3[cH:21][c:20]([Cl:19])[c:26]([O:27][c:28]4[cH:29][c:30]([C:34]([F:35])([F:36])[F:37])[cH:31][cH:32][cH:33]4)[cH:25][cH:24]3)[c:17]12Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-df9fbbe254e847c986cc9b5e27b8b69a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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