Ammonia → 1-[3-(7-Oxotriazolo[4,5-d]pyrimidin-5-yl)-4-propoxyphenyl]-3-propan-2-ylurea
Reaction equation
[CH3:30][N:31]1[CH2:32][CH2:33][CH2:34][C:35]1=[O:36].[CH:22]([CH3:23])([CH3:24])[N:25]=[C:26]=[O:27].[ClH:29].[NH2:1][c:2]1[cH:3][cH:4][c:5]([O:18][CH2:19][CH2:20][CH3:21])[c:6]([C:8]2=[N:9][C:10](=[O:17])[C:11]3=[N:12][N:13]=[N:14][C:15]3=[N:16]2)[cH:7]1.[NH3:28]>>[NH:1]([c:2]1[cH:3][cH:4][c:5]([O:18][CH2:19][CH2:20][CH3:21])[c:6]([C:8]2=[N:9][C:10](=[O:17])[C:11]3=[N:12][N:13]=[N:14][C:15]3=[N:16]2)[cH:7]1)[C:26]([NH:25][CH:22]([CH3:23])[CH3:24])=[O:27]Participants
6
Sources & evidence
- ORD record
- ord-daa9f196709b42b79482457b7fa9ff79
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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