Bicarbonate Ion → N-(5'-Bromo-4,4-difluorospiro[cyclohexane-1,2'-indene]-3'(1'H)-ylidene)-2-methylpropane-2-sulfinamide
Reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]2[c:16]([cH:17]1)[C:15](=[O:18])[C:7]1([CH2:6]2)[CH2:8][CH2:9][C:10]([F:13])([F:14])[CH2:11][CH2:12]1.[CH2:37]1[O:38][CH2:39][CH2:40][CH2:41]1.[CH3:19][C:20]([CH3:21])([CH3:22])[S:23](=[O:24])[NH2:25].[CH3:26][CH2:27][O:28][C:29]([CH3:30])=[O:31].[CH3:42][CH2:43][CH2:44][CH2:45][CH2:46][CH2:47][CH3:48].[CH3:49][CH2:50][O-:51].[CH3:53][CH2:54][O-:55].[CH3:56][CH2:57][O-:58].[CH3:59][CH2:60][O-:61].[Na+:36].[O-:32][C:33]([OH:34])=[O:35].[Ti+4:52]>>[Br:1][c:2]1[cH:3][cH:4][c:5]2[c:16]([cH:17]1)[C:15](=[N:25][S:23]([C:20]([CH3:19])([CH3:21])[CH3:22])=[O:24])[C:7]1([CH2:6]2)[CH2:8][CH2:9][C:10]([F:13])([F:14])[CH2:11][CH2:12]1Participants
10
Reactant 9
Product 1
Sources & evidence
- ORD record
- ord-e0df57b32ef9431bbf14452d76de1016
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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