Water → HCID 25052168, compound
Reaction equation
[CH2:38]1[O:39][CH2:40][CH2:41][CH2:42]1.[CH3:24][CH2:25][N:26]([CH2:27][CH3:28])[CH2:29][CH3:30].[CH3:43][CH2:44][O:45][C:46](=[O:47])[CH3:48].[CH:31]1([C:34](=[O:35])[Cl:36])[CH2:32][CH2:33]1.[NH2:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9]([CH2:22][CH3:23])[c:10]3[cH:11][c:12]([O:19][CH2:20][CH3:21])[cH:13][cH:14][c:15]3[c:16]2[C:17]#[N:18])[cH:6][cH:7]1.[OH2:37]>>[NH:1]([c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9]([CH2:22][CH3:23])[c:10]3[cH:11][c:12]([O:19][CH2:20][CH3:21])[cH:13][cH:14][c:15]3[c:16]2[C:17]#[N:18])[cH:6][cH:7]1)[C:34]([CH:31]1[CH2:32][CH2:33]1)=[O:35]Participants
7
Sources & evidence
- ORD record
- ord-649ec59542c74ed8be0bd85f631a6c4e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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