1,2-Dichloroethane → HCID 67433005, compound
Reaction equation
[CH2:45]([Cl:46])[CH2:47][Cl:48].[CH3:1][C:2]([C:3](=[O:4])[OH:5])([CH2:6][c:7]1[s:8][c:9](-[c:12]2[cH:13][c:14]([CH3:29])[cH:15][c:16]([NH:18][c:19]3[n:20][cH:21][cH:22][c:23]([C:25]([F:26])([F:27])[F:28])[n:24]3)[cH:17]2)[cH:10][n:11]1)[CH3:30].[CH:31](=[O:32])[NH:33][NH2:34].[CH:49]([N:50]([CH2:51][CH3:52])[CH:53]([CH3:54])[CH3:55])([CH3:56])[CH3:57].[O:59]=[CH:60][N:61]([CH3:62])[CH3:63].[OH2:58].[OH:35][n:36]1[c:37]2[c:38]([cH:39][cH:40][cH:41][cH:42]2)[n:43][n:44]1>>[CH3:1][C:2]([C:3](=[O:5])[NH:34][NH:33][CH:31]=[O:32])([CH2:6][c:7]1[s:8][c:9](-[c:12]2[cH:13][c:14]([CH3:29])[cH:15][c:16]([NH:18][c:19]3[n:20][cH:21][cH:22][c:23]([C:25]([F:26])([F:27])[F:28])[n:24]3)[cH:17]2)[cH:10][n:11]1)[CH3:30]Participants
8
Sources & evidence
- ORD record
- ord-9f121fcf6f0c47f2996be1938b15b037
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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