Theophylline → 7-[2-(5-Methyl-1,2,4-oxadiazol-3-yl)-ethan-1-yl]-theophylline
Reaction equation
[CH:24]([OH:25])([CH3:26])[CH3:27].[Cl:1][CH2:2][CH2:3][c:4]1[n:5][o:6][c:7]([CH3:9])[n:8]1.[Na:10].[n:11]1([CH3:12])[c:13](=[O:14])[n:15]([CH3:16])[c:17]2[n:18][cH:19][nH:20][c:21]2[c:22]1=[O:23]>>[CH2:2]([CH2:3][c:4]1[n:5][o:6][c:7]([CH3:9])[n:8]1)[n:20]1[cH:19][n:18][c:17]2[n:15]([CH3:16])[c:13](=[O:14])[n:11]([CH3:12])[c:22](=[O:23])[c:21]21Participants
5
Sources & evidence
- ORD record
- ord-f9920afae1c346209d1d4937370e33c6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
Loading…