1,2-Dichloroethane → HCID 178444884, compound
Reaction equation
[C:26]([CH3:27])([CH3:28])([CH3:29])[O:30][C:31](=[O:32])[NH:33][CH:34]([CH2:35][C:36]([CH3:37])([CH3:38])[CH3:39])[C:40](=[O:41])[OH:42].[CH2:43]([Cl:44])[CH2:45][Cl:46].[CH3:71][CH2:72][O:73][C:74]([CH3:75])=[O:76].[CH:57]([N:58]([CH2:59][CH3:60])[CH:61]([CH3:62])[CH3:63])([CH3:64])[CH3:65].[ClH:1].[O:66]=[CH:67][N:68]([CH3:69])[CH3:70].[OH:47][n:48]1[c:49]2[n:50][cH:51][cH:52][cH:53][c:54]2[n:55][n:56]1.[n:2]1(-[c:7]2[c:8]([CH2:9][NH:10][C:11]([CH:12]3[NH:13][CH2:14][CH2:15][CH2:16]3)=[O:17])[cH:18][c:19]([C:22]([F:23])([F:24])[F:25])[cH:20][cH:21]2)[n:3][n:4][n:5][cH:6]1>>[n:2]1(-[c:7]2[c:8]([CH2:9][NH:10][C:11]([CH:12]3[N:13]([C:40]([CH:34]([NH:33][C:31]([O:30][C:26]([CH3:27])([CH3:28])[CH3:29])=[O:32])[CH2:35][C:36]([CH3:37])([CH3:38])[CH3:39])=[O:41])[CH2:14][CH2:15][CH2:16]3)=[O:17])[cH:18][c:19]([C:22]([F:23])([F:24])[F:25])[cH:20][cH:21]2)[n:3][n:4][n:5][cH:6]1Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-3098da1acc154afa8d0cb0f95dfcd868
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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