Dimethyl Sulfoxide → 1-(5-Oxohexyl)-3-methyl-7-(methylpivaloyl)xanthine
Reaction equation
[Br:22][CH2:23][CH2:24][CH2:25][CH2:26][C:27]([CH3:28])=[O:29].[CH3:1][n:2]1[c:3](=[O:19])[nH:4][c:5](=[O:18])[c:6]2[n:7]([C:11]([C:12]([CH2:13][CH3:14])([CH3:15])[CH3:16])=[O:17])[cH:8][n:9][c:10]12.[CH3:31][S:32]([CH3:33])=[O:34].[H-:21].[Na+:20].[OH2:30]>>[CH3:1][n:2]1[c:3](=[O:19])[n:4]([CH2:23][CH2:24][CH2:25][CH2:26][C:27]([CH3:28])=[O:29])[c:5](=[O:18])[c:6]2[n:7]([C:11]([C:12]([CH2:13][CH3:14])([CH3:15])[CH3:16])=[O:17])[cH:8][n:9][c:10]12Participants
7
Sources & evidence
- ORD record
- ord-7f3952a84a4144b3ac3784ff3979952f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
Loading…