Water → HCID 12115053, compound
Reaction equation
[CH2:45]([Cl:46])[Cl:47].[Cl:33][c:34]1[cH:35][cH:36][cH:37][c:38]([C:39]([O:40][OH:42])=[O:41])[cH:43]1.[OH2:44].[n:1]1([CH2:10][c:11]2[c:12]([Cl:32])[c:13](-[c:24]3[cH:25][cH:26][c:27]([O:30][CH3:31])[cH:28][cH:29]3)[c:14]3[c:15]([n:16]2)[s:17][c:18]2[c:19]3[CH2:20][CH2:21][S:22][CH2:23]2)[cH:2][n:3][c:4]2[c:5]1[cH:6][cH:7][cH:8][cH:9]2>>[n:1]1([CH2:10][c:11]2[c:12]([Cl:32])[c:13](-[c:24]3[cH:25][cH:26][c:27]([O:30][CH3:31])[cH:28][cH:29]3)[c:14]3[c:15]([n:16]2)[s:17][c:18]2[c:19]3[CH2:20][CH2:21][S:22](=[O:41])[CH2:23]2)[cH:2][n:3][c:4]2[c:5]1[cH:6][cH:7][cH:8][cH:9]2Participants
5
Sources & evidence
- ORD record
- ord-035db6fea4344db7af39dbdffe873aae
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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