1,2-Dichloroethane → HCID 66665680, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][C:8]1=[N:13][C:12]([CH2:14][F:15])([c:16]2[c:17]([F:23])[cH:18][cH:19][c:20]([NH2:22])[cH:21]2)[CH2:11][O:10][CH2:9]1)=[O:24].[CH2:45]([Cl:46])[CH2:47][Cl:48].[CH3:49][CH2:50][N:51]([CH2:52][CH3:53])[CH2:54][CH3:55].[Cl:25][c:26]1[cH:27][cH:28][c:29]([C:32](=[O:33])[OH:34])[n:30][cH:31]1.[Cl:56][CH2:57][Cl:58].[OH:35][n:36]1[c:37]2[n:38][cH:39][cH:40][cH:41][c:42]2[n:43][n:44]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][C:8]1=[N:13][C:12]([CH2:14][F:15])([c:16]2[c:17]([F:23])[cH:18][cH:19][c:20]([NH:22][C:32]([c:29]3[cH:28][cH:27][c:26]([Cl:25])[cH:31][n:30]3)=[O:33])[cH:21]2)[CH2:11][O:10][CH2:9]1)=[O:24]Participants
7
Sources & evidence
- ORD record
- ord-ccdb38351b694a038211a61ca7c5a989
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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