Water → 1-[3-[tert-butyl(dimethyl)silyl]oxycyclopentyl]-3-(4-ethylphenyl)-7-(4-fluoroanilino)-4H-pyrimido[4,5-d]pyrimidin-2-one
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[Si:5]([O:6][CH:7]1[CH2:8][CH:9]([N:12]2[C:13](=[O:31])[N:14]([c:23]3[cH:24][cH:25][c:26]([CH2:29][CH3:30])[cH:27][cH:28]3)[CH2:15][c:16]3[c:17]2[n:18][c:19]([Cl:22])[n:20][cH:21]3)[CH2:10][CH2:11]1)([CH3:32])[CH3:33].[CH3:54][CH:55]([OH:56])[CH3:57].[Cl:58][CH2:59][Cl:60].[NH2:34][c:35]1[cH:36][cH:37][c:38]([F:39])[cH:40][cH:41]1.[OH2:42].[c:43]1([CH3:44])[cH:45][cH:46][c:47]([S:48]([OH:49])(=[O:50])=[O:51])[cH:52][cH:53]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[Si:5]([O:6][CH:7]1[CH2:8][CH:9]([N:12]2[C:13](=[O:31])[N:14]([c:23]3[cH:24][cH:25][c:26]([CH2:29][CH3:30])[cH:27][cH:28]3)[CH2:15][c:16]3[c:17]2[n:18][c:19]([NH:34][c:35]2[cH:36][cH:37][c:38]([F:39])[cH:40][cH:41]2)[n:20][cH:21]3)[CH2:10][CH2:11]1)([CH3:32])[CH3:33]Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-f20dcfd8d9b84a8a91507800245aeac1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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