Acetic Acid → HCID 178477627, compound
Reaction equation
[CH2:52]([OH:53])[CH3:54].[CH3:44][C:45](=[O:46])[OH:47].[Cl:1][c:2]1[cH:3][c:4]([C:5](=[O:6])[NH:7][CH:8]([CH2:9][S:10][CH2:11][CH3:12])[c:13]2[n:14][c:15]3[c:16]([nH:17]2)[cH:18][cH:19][c:20]([Cl:22])[cH:21]3)[cH:23][cH:24][c:25]1[C:26](=[O:27])[N:28]1[CH2:29][CH2:30][CH2:31][CH2:32]1.[Cl:48].[Cl:49][CH2:50][Cl:51].[Cl:55][CH2:56][Cl:57].[OH:33][O:34][C:35]([c:36]1[cH:37][c:38]([Cl:39])[cH:40][cH:41][cH:42]1)=[O:43]>>[Cl:1][c:2]1[cH:3][c:4]([C:5](=[O:6])[NH:7][CH:8]([CH2:9][S:10]([CH2:11][CH3:12])=[O:33])[c:13]2[n:14][c:15]3[c:16]([nH:17]2)[cH:18][cH:19][c:20]([Cl:22])[cH:21]3)[cH:23][cH:24][c:25]1[C:26](=[O:27])[N:28]1[CH2:29][CH2:30][CH2:31][CH2:32]1Participants
7
Sources & evidence
- ORD record
- ord-5526a0e2863c41fa9235586fd315de77
- Source dataset
- Validation data from https://doi.org/10.1039/C8SC04228D
Reaction notes
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