Citric Acid → 4-(3-Chloro-4-methoxybenzylamino)-5-carboxy-6-chloro-2-methylthiopyrimidine
Reaction equation
[CH3:14][CH2:15][N:16]([CH2:17][CH3:18])[CH2:19][CH3:20].[CH3:32][N:33]([CH3:34])[CH:35]=[O:36].[Cl:1][c:2]1[n:3][c:4]([S:12][CH3:13])[n:5][c:6]([Cl:11])[c:7]1[C:8](=[O:9])[OH:10].[Cl:21][c:22]1[cH:23][c:24]([CH2:25][NH2:26])[cH:27][cH:28][c:29]1[O:30][CH3:31].[OH:37][C:38]([CH2:39][C:40]([C:41](=[O:42])[OH:43])([CH2:44][C:45](=[O:46])[OH:47])[OH:48])=[O:49]>>[c:2]1([NH:26][CH2:25][c:24]2[cH:23][c:22]([Cl:21])[c:29]([O:30][CH3:31])[cH:28][cH:27]2)[n:3][c:4]([S:12][CH3:13])[n:5][c:6]([Cl:11])[c:7]1[C:8](=[O:9])[OH:10]Participants
6
Sources & evidence
- ORD record
- ord-1272a4a96e08410aa1b32ff9125edd1a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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