Water → 1-{4-[6-(4-Benzyloxyphenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-yloxy]-2-chlorophenyl}-3-cyclopropylurea
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12](-[c:15]2[cH:16][c:17]3[c:18]([n:19][cH:20][n:21][c:22]3[O:23][c:24]3[cH:25][c:26]([Cl:37])[c:27]([NH:30][C:31](=[O:32])[NH:33][CH:34]4[CH2:35][CH2:36]4)[cH:28][cH:29]3)[n:38]2[CH2:39][O:40][CH2:41][CH2:42][Si:43]([CH3:44])([CH3:45])[CH3:46])[cH:13][cH:14]1.[CH3:54][CH2:55][CH2:56][CH2:57][N+:58]([CH2:59][CH2:60][CH2:61][CH3:62])([CH2:63][CH2:64][CH2:65][CH3:66])[CH2:67][CH2:68][CH2:69][CH3:70].[F-:53].[O:48]1[CH2:49][CH2:50][CH2:51][CH2:52]1.[OH2:47]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12](-[c:15]2[cH:16][c:17]3[c:18]([n:19][cH:20][n:21][c:22]3[O:23][c:24]3[cH:25][c:26]([Cl:37])[c:27]([NH:30][C:31](=[O:32])[NH:33][CH:34]4[CH2:35][CH2:36]4)[cH:28][cH:29]3)[nH:38]2)[cH:13][cH:14]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-fe5a94393b0b4affa99b3c50fc7e852e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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