1,2-Dichloroethane → HCID 178446812, compound
Reaction equation
[CH2:13]([Cl:14])[CH2:15][Cl:16].[CH3:1][O:2][C:3](=[O:4])[NH:5][CH:6]([CH:7]([CH3:8])[CH3:9])[C:10](=[O:11])[OH:12].[O:65]=[CH:66][N:67]([CH3:68])[CH3:69].[OH:17][n:18]1[c:19]2[c:20]([cH:21][cH:22][cH:23][cH:24]2)[n:25][n:26]1.[s:27]1[cH:28][n:29][cH:30][c:31]1-[c:32]1[cH:33][cH:34][c:35]([CH2:38][N:39]([CH2:40][CH:41]([CH:42]([CH2:43][c:44]2[cH:45][cH:46][cH:47][cH:48][cH:49]2)[NH:50][C:51]([CH:52]([NH:53][C:54](=[O:55])[O:56][CH3:57])[CH:58]([CH3:59])[CH2:60][CH3:61])=[O:62])[OH:63])[NH2:64])[cH:36][cH:37]1>>[CH3:1][O:2][C:3](=[O:4])[NH:5][CH:6]([CH:7]([CH3:8])[CH3:9])[C:10](=[O:12])[NH:64][N:39]([CH2:38][c:35]1[cH:34][cH:33][c:32](-[c:31]2[s:27][cH:28][n:29][cH:30]2)[cH:37][cH:36]1)[CH2:40][CH:41]([CH:42]([CH2:43][c:44]1[cH:45][cH:46][cH:47][cH:48][cH:49]1)[NH:50][C:51]([CH:52]([NH:53][C:54](=[O:55])[O:56][CH3:57])[CH:58]([CH3:59])[CH2:60][CH3:61])=[O:62])[OH:63]Participants
6
Sources & evidence
- ORD record
- ord-cbeed0644c794a5788e194cddec782ec
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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