1,2-Dichloroethane → HCID 11706086, compound
Reaction equation
[CH2:36]([Cl:37])[CH2:38][Cl:39].[CH2:48]([Cl:49])[Cl:50].[CH3:41][CH2:42][N:43]([CH2:44][CH3:45])[CH2:46][CH3:47].[ClH:40].[F:1][c:2]1[cH:3][c:4]([CH2:9][C:10](=[O:11])[NH:12][CH:13]([C:14](=[O:15])[OH:16])[CH2:17][CH2:18][CH3:19])[cH:5][c:6]([F:8])[cH:7]1.[c:20]1([CH:26]([CH2:27][S:28][c:29]2[n:30][n:31][c:32]([NH2:34])[s:33]2)[CH3:35])[cH:21][cH:22][cH:23][cH:24][cH:25]1>>[F:1][c:2]1[cH:3][c:4]([CH2:9][C:10](=[O:11])[NH:12][CH:13]([C:14](=[O:16])[NH:34][c:32]2[n:31][n:30][c:29]([S:28][CH2:27][CH:26]([c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[CH3:35])[s:33]2)[CH2:17][CH2:18][CH3:19])[cH:5][c:6]([F:8])[cH:7]1Participants
7
Sources & evidence
- ORD record
- ord-6ca6422686e04bd3b99f810724b4b324
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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