Water → HCID 86655380, compound
Reaction equation
[CH3:38][N:39]([CH3:40])[c:41]1[cH:42][cH:43][n:44][cH:45][cH:46]1.[CH:31]1([C:34](=[O:35])[Cl:36])[CH2:32][CH2:33]1.[NH2:1][c:2]1[s:3][c:4]2[c:5]([n:6]1)[cH:7][cH:8][c:9]([O:11][c:12]1[cH:13][c:14]([C:15](=[O:16])[NH:17][c:18]3[cH:19][c:20]([C:24]([F:25])([F:26])[F:27])[cH:21][cH:22][cH:23]3)[cH:28][cH:29][cH:30]1)[cH:10]2.[OH2:37].[cH:47]1[cH:48][cH:49][n:50][cH:51][cH:52]1>>[NH:1]([c:2]1[s:3][c:4]2[c:5]([n:6]1)[cH:7][cH:8][c:9]([O:11][c:12]1[cH:13][c:14]([C:15](=[O:16])[NH:17][c:18]3[cH:19][c:20]([C:24]([F:25])([F:26])[F:27])[cH:21][cH:22][cH:23]3)[cH:28][cH:29][cH:30]1)[cH:10]2)[C:34]([CH:31]1[CH2:32][CH2:33]1)=[O:35]Participants
6
Sources & evidence
- ORD record
- ord-5187c214d9204f70857f87385e1a294d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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