Water → HCID 54412720, compound
Reaction equation
[CH3:34][C:35](=[O:36])[O:37][C:38](=[O:39])[CH3:40].[CH3:47][N:48]([CH3:49])[CH:50]=[O:51].[NH2:1][c:2]1[cH:3][c:4]([NH:8][C:9]([CH:10]([C:11](=[O:12])[c:13]2[c:14]3[c:15]([n:16](-[c:18]4[cH:19][cH:20][cH:21][cH:22][cH:23]4)[n:17]2)-[c:24]2[cH:25][cH:26][cH:27][cH:28][c:29]2[CH2:30]3)[C:31]#[N:32])=[O:33])[cH:5][cH:6][cH:7]1.[OH2:52].[cH:41]1[cH:42][cH:43][n:44][cH:45][cH:46]1>>[NH:1]([c:2]1[cH:3][c:4]([NH:8][C:9]([CH:10]([C:11](=[O:12])[c:13]2[c:14]3[c:15]([n:16](-[c:18]4[cH:19][cH:20][cH:21][cH:22][cH:23]4)[n:17]2)-[c:24]2[cH:25][cH:26][cH:27][cH:28][c:29]2[CH2:30]3)[C:31]#[N:32])=[O:33])[cH:5][cH:6][cH:7]1)[C:35]([CH3:34])=[O:36]Participants
6
Sources & evidence
- ORD record
- ord-c087f91e49dc4f0fb643b9ec6372b483
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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