Water → HCID 21104354, compound
Reaction equation
[CH3:40][c:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1.[CH3:47][CH2:48][O:49][C:50]([CH3:51])=[O:52].[Cl:1][c:2]1[n:3][c:4]([CH3:18])[n:5][c:6]2[c:11]1[CH2:10][CH2:9][CH2:8][C:7]2([CH2:12][CH2:13][CH3:14])[CH2:15][CH2:16][CH3:17].[NH2:19][c:20]1[cH:21][cH:22][c:23]([Cl:24])[cH:25][c:26]1[Cl:27].[OH2:28].[c:29]1([CH3:30])[cH:31][cH:32][c:33]([S:34]([OH:35])(=[O:36])=[O:37])[cH:38][cH:39]1>>[c:2]1([NH:19][c:20]2[cH:21][cH:22][c:23]([Cl:24])[cH:25][c:26]2[Cl:27])[n:3][c:4]([CH3:18])[n:5][c:6]2[c:11]1[CH2:10][CH2:9][CH2:8][C:7]2([CH2:12][CH2:13][CH3:14])[CH2:15][CH2:16][CH3:17]Participants
7
Sources & evidence
- ORD record
- ord-dcdb8eb0339d44d5a59b1c95f6c99999
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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