Acetic Acid → 4-(5-Iodo-1H-pyrazol-4-yl)-2-(methylsulfanyl)pyrimidine
Reaction equation
[CH3:36][C:37](=[O:38])[OH:39].[CH3:5][S:6][c:7]1[n:8][cH:9][cH:10][c:11](-[c:13]2[cH:14][n:15][nH:16][c:17]2[NH2:18])[n:12]1.[I-:25].[I:27].[K+:24].[N:1]([O-:2])=[O:3].[NH3:26].[Na+:28].[Na+:29].[Na+:4].[O-:30][S:31]([O-:32])(=[S:33])=[O:34].[OH2:35].[S:19](=[O:20])(=[O:21])([OH:22])[OH:23]>>[CH3:5][S:6][c:7]1[n:8][cH:9][cH:10][c:11](-[c:13]2[cH:14][n:15][nH:16][c:17]2[I:25])[n:12]1Participants
12
Reactant 11
Product 1
Sources & evidence
- ORD record
- ord-81a40ce893d64d768d7a15f35a628143
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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