1,2-Dichloroethane → HCID 20738480, compound
Reaction equation
[CH2:41]([Cl:42])[CH2:43][Cl:44].[CH3:18][O:19][c:20]1[cH:21][c:22]([CH2:37][C:38](=[O:39])[OH:40])[cH:23][cH:24][c:25]1[NH:26][C:27](=[O:28])[NH:29][c:30]1[c:31]([CH3:36])[cH:32][cH:33][cH:34][cH:35]1.[CH3:55][N:56]([c:57]1[cH:58][cH:59][n:60][cH:61][cH:62]1)[CH3:63].[CH3:69][CH2:70][O:71][C:72]([CH3:73])=[O:74].[NH:1]1[CH:2]([CH2:6][NH:7][c:8]2[cH:9][cH:10][c:11]([C:12](=[O:13])[O:14][CH3:15])[cH:16][cH:17]2)[CH2:3][CH2:4][CH2:5]1.[O:64]=[CH:65][N:66]([CH3:67])[CH3:68].[OH:45][n:46]1[c:47]2[c:48]([cH:49][cH:50][cH:51][cH:52]2)[n:53][n:54]1>>[N:1]1([C:38]([CH2:37][c:22]2[cH:21][c:20]([O:19][CH3:18])[c:25]([NH:26][C:27](=[O:28])[NH:29][c:30]3[c:31]([CH3:36])[cH:32][cH:33][cH:34][cH:35]3)[cH:24][cH:23]2)=[O:39])[CH:2]([CH2:6][NH:7][c:8]2[cH:9][cH:10][c:11]([C:12](=[O:13])[O:14][CH3:15])[cH:16][cH:17]2)[CH2:3][CH2:4][CH2:5]1Participants
8
Sources & evidence
- ORD record
- ord-cad70aabc9b04729b30969f02446379d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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