Hydrochloric Acid → 3-amino-5-(1-isopropyl-7-(methylthio)-2-oxo-1,2-dihydropyrimido[4,5-d]pyrimidin-3(4H)-yl)benzonitrile
Reaction equation
[CH3:29][OH:30].[CH:1]([CH3:2])([CH3:3])[N:4]1[C:5](=[O:27])[N:6]([c:16]2[cH:17][c:18]([C:19]#[N:20])[cH:21][c:22]([N+:24]([O-:25])=[O:26])[cH:23]2)[CH2:7][c:8]2[c:9]1[n:10][c:11]([S:14][CH3:15])[n:12][cH:13]2.[ClH:28].[Fe:31]>>[CH:1]([CH3:2])([CH3:3])[N:4]1[C:5](=[O:27])[N:6]([c:16]2[cH:17][c:18]([C:19]#[N:20])[cH:21][c:22]([NH2:24])[cH:23]2)[CH2:7][c:8]2[c:9]1[n:10][c:11]([S:14][CH3:15])[n:12][cH:13]2Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-e2473f4454ad4d739e98bfb5d13b6f06
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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