Bicarbonate Ion → 4-{[6-(3-Methanesulfonyl-4-methoxy-phenyl)-4-(1-trifluoromethyl-cyclopropylamino)-pyrido[3,2-d]pyrimidin-2-ylamino]-methyl}-benzenesulfonamide
Reaction equation
[C:53](=[O:54])([OH:55])[O-:56].[CH3:32][S:33](=[O:34])(=[O:35])[c:36]1[cH:37][c:38]([B:44]2[O:45][C:46]([CH3:47])([CH3:48])[C:49]([CH3:50])([CH3:51])[O:52]2)[cH:39][cH:40][c:41]1[O:42][CH3:43].[CH3:58][O:59][CH2:60][CH2:61][O:62][CH3:63].[Cl:1][c:2]1[cH:3][cH:4][c:5]2[n:6][c:7]([NH:20][CH2:21][c:22]3[cH:23][cH:24][c:25]([S:28](=[O:29])(=[O:30])[NH2:31])[cH:26][cH:27]3)[n:8][c:9]([NH:12][C:13]3([C:16]([F:17])([F:18])[F:19])[CH2:14][CH2:15]3)[c:10]2[n:11]1.[Na+:57]>>[c:2]1(-[c:38]2[cH:37][c:36]([S:33]([CH3:32])(=[O:34])=[O:35])[c:41]([O:42][CH3:43])[cH:40][cH:39]2)[cH:3][cH:4][c:5]2[n:6][c:7]([NH:20][CH2:21][c:22]3[cH:23][cH:24][c:25]([S:28](=[O:29])(=[O:30])[NH2:31])[cH:26][cH:27]3)[n:8][c:9]([NH:12][C:13]3([C:16]([F:17])([F:18])[F:19])[CH2:14][CH2:15]3)[c:10]2[n:11]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-730e5471a0b642378418b67ad56d8109
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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