Water → [4-Benzoyloxy-5-[6-[2,2-bis(4-chlorophenyl)ethylamino]-2-cyanopurin-9-yl]-2-(ethylcarbamoyl)oxolan-3-yl] benzoate
Reaction equation
[C:4]([c:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1)(=[O:11])[O:12][CH:13]1[CH:14]([n:32]2[c:33]3[n:34][c:35]([I:58])[n:36][c:37]([NH:41][CH2:42][CH:43]([c:44]4[cH:45][cH:46][c:47]([Cl:50])[cH:48][cH:49]4)[c:51]4[cH:52][cH:53][c:54]([Cl:57])[cH:55][cH:56]4)[c:38]3[n:39][cH:40]2)[O:15][CH:16]([C:27](=[O:28])[NH:29][CH2:30][CH3:31])[CH:17]1[O:18][C:19]([c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1)=[O:26].[Cu:1][C:2]#[N:3].[OH2:59]>>[C:2](#[N:3])[c:35]1[n:34][c:33]2[n:32]([CH:14]3[CH:13]([O:12][C:4]([c:5]4[cH:6][cH:7][cH:8][cH:9][cH:10]4)=[O:11])[CH:17]([O:18][C:19]([c:20]4[cH:21][cH:22][cH:23][cH:24][cH:25]4)=[O:26])[CH:16]([C:27](=[O:28])[NH:29][CH2:30][CH3:31])[O:15]3)[cH:40][n:39][c:38]2[c:37]([NH:41][CH2:42][CH:43]([c:44]2[cH:45][cH:46][c:47]([Cl:50])[cH:48][cH:49]2)[c:51]2[cH:52][cH:53][c:54]([Cl:57])[cH:55][cH:56]2)[n:36]1Participants
4
Reactant 3
Product 1
Sources & evidence
- ORD record
- ord-ed3c9cd9aea64eb98cb2b3ecd3b42ed9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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