Bicarbonate Ion → 2-(Methylsulfinyl)-7-(4-(methylsulfonyl)phenyl)pyrrolo[2,1-f][1,2,4]triazine
Reaction equation
[CH2:22]([Cl:23])[Cl:24].[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8](-[c:11]2[cH:12][cH:13][c:14]3[cH:15][n:16][c:17]([S:20][CH3:21])[n:18][n:19]23)[cH:9][cH:10]1.[Cl:25][c:26]1[cH:27][cH:28][cH:29][c:30]([C:31]([O:32][OH:34])=[O:33])[cH:35]1.[Na+:40].[O-:36][C:37]([OH:38])=[O:39]>>[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8](-[c:11]2[cH:12][cH:13][c:14]3[cH:15][n:16][c:17]([S:20]([CH3:21])=[O:33])[n:18][n:19]23)[cH:9][cH:10]1Participants
6
Sources & evidence
- ORD record
- ord-f7a92a21d16e4297ac6c5f145e58046b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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