Water → HCID 12822549, compound
Reaction equation
[CH3:31][S:32]([OH:33])(=[O:34])=[O:35].[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH:8]2[CH2:9][C:10](=[O:11])[O:12][C:13](=[O:15])[CH2:14]2)[cH:6][cH:7]1.[NH2:16][c:17]1[cH:18][cH:19][n:20][cH:21][cH:22]1.[OH2:36].[c:23]1([CH3:24])[c:25]([CH3:26])[cH:27][cH:28][cH:29][cH:30]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH:8]2[CH2:9][C:10](=[O:12])[N:16]([c:17]3[cH:18][cH:19][n:20][cH:21][cH:22]3)[C:13](=[O:15])[CH2:14]2)[cH:6][cH:7]1Participants
6
Sources & evidence
- ORD record
- ord-3b3dfc9d566540a09b3fe83ee587d70c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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