1,2-Dichloroethane → HCID 178427434, compound
Reaction equation
[C:40]([OH:41])(=[O:42])[CH3:43].[CH2:34]1[CH2:35][CH2:36][NH:37][CH2:38][CH2:39]1.[CH:1](=[O:2])[c:3]1[cH:4][c:5]2[c:10]([cH:11][cH:12]1)[CH:9]([n:13]1[n:14][n:15][c:16]([CH2:18][CH:19]([C:20](=[O:21])[NH2:22])[NH:23][S:24](=[O:25])(=[O:26])[c:27]3[cH:28][cH:29][c:30]([CH3:33])[cH:31][cH:32]3)[cH:17]1)[CH2:8][CH2:7][CH2:6]2.[Cl:44][CH2:45][CH2:46][Cl:47]>>[CH2:1]([c:3]1[cH:4][c:5]2[c:10]([cH:11][cH:12]1)[CH:9]([n:13]1[n:14][n:15][c:16]([CH2:18][CH:19]([C:20](=[O:21])[NH2:22])[NH:23][S:24](=[O:25])(=[O:26])[c:27]3[cH:28][cH:29][c:30]([CH3:33])[cH:31][cH:32]3)[cH:17]1)[CH2:8][CH2:7][CH2:6]2)[N:37]1[CH2:36][CH2:35][CH2:34][CH2:39][CH2:38]1Participants
5
Sources & evidence
- ORD record
- ord-8e67d37d3baf4e589cc2e83f67695856
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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