Ethyl Acetate → HCID 66833304, compound
Reaction equation
[CH2:40]([N:41]([CH:42]([CH3:43])[CH3:44])[CH:45]([CH3:46])[CH3:47])[CH3:48].[CH3:49][N:50]1[CH2:51][CH2:52][CH2:53][C:54]1=[O:55].[CH3:56][CH2:57][O:58][C:59](=[O:60])[CH3:61].[Cl:1][c:2]1[n:3][cH:4][c:5]([C:6](=[O:7])[NH2:8])[c:9]([NH:11][c:12]2[cH:13][cH:14][c:15]([C:18](=[O:19])[N:20]3[CH2:21][CH2:22][O:23][CH2:24][CH2:25]3)[cH:16][cH:17]2)[cH:10]1.[NH:26]1[CH2:27][CH:28]([NH:32][C:33]([O:34][C:35]([CH3:36])([CH3:37])[CH3:38])=[O:39])[CH2:29][CH2:30][CH2:31]1>>[c:2]1([N:26]2[CH2:27][CH:28]([NH:32][C:33]([O:34][C:35]([CH3:36])([CH3:37])[CH3:38])=[O:39])[CH2:29][CH2:30][CH2:31]2)[n:3][cH:4][c:5]([C:6](=[O:7])[NH2:8])[c:9]([NH:11][c:12]2[cH:13][cH:14][c:15]([C:18](=[O:19])[N:20]3[CH2:21][CH2:22][O:23][CH2:24][CH2:25]3)[cH:16][cH:17]2)[cH:10]1Participants
6
Sources & evidence
- ORD record
- ord-659c6d6295f84245b7a5a6164c4f79a5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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