Bicarbonate Ion → [6-Bromo-1-isopropyl-5-(1-isopropyl-piperidin-4-yloxy)-1H-indol-2-yl]-[4-(piperidine-1-sulfonyl)-piperazin-1-yl]-methanone
Reaction equation
[Br:1][c:2]1[c:3]([O:28][CH:29]2[CH2:30][CH2:31][N:32]([CH:35]([CH3:36])[CH3:37])[CH2:33][CH2:34]2)[cH:4][c:5]2[cH:6][c:7]([C:11](=[O:12])[N:13]3[CH2:14][CH2:15][N:16]([S:19](=[O:20])(=[O:21])[N:22]4[CH2:23][CH2:24][CH2:25][CH2:26][CH2:27]4)[CH2:17][CH2:18]3)[nH:8][c:9]2[cH:10]1.[C:38](=[O:39])([O-:40])[O-:41].[C:52](=[O:53])([OH:54])[O-:55].[CH3:44][S:45]([O:46][CH:49]([CH3:50])[CH3:51])(=[O:47])=[O:48].[CH3:57][C:58]#[N:59].[Cs+:42].[Cs+:43].[Na+:56]>>[Br:1][c:2]1[c:3]([O:28][CH:29]2[CH2:30][CH2:31][N:32]([CH:35]([CH3:36])[CH3:37])[CH2:33][CH2:34]2)[cH:4][c:5]2[cH:6][c:7]([C:11](=[O:12])[N:13]3[CH2:14][CH2:15][N:16]([S:19](=[O:20])(=[O:21])[N:22]4[CH2:23][CH2:24][CH2:25][CH2:26][CH2:27]4)[CH2:17][CH2:18]3)[n:8]([CH:49]([CH3:50])[CH3:51])[c:9]2[cH:10]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-6c1b064ded4b4f73a9d2cc988e75e0e2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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