1,2-Dichloroethane → HCID 23512537, compound
Reaction equation
[CH2:23]([CH3:24])[O:25][C:26](=[O:27])[c:28]1[cH:29][cH:30][c:31]([C:34]#[C:35][CH:36]2[NH:37][CH2:38][CH2:39][CH2:40]2)[cH:32][cH:33]1.[CH2:41]([Cl:42])[CH2:43][Cl:44].[CH3:1][O:2][c:3]1[cH:4][c:5]([CH2:19][C:20](=[O:21])[OH:22])[cH:6][cH:7][c:8]1[NH:9][C:10](=[O:11])[NH:12][c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1.[CH3:56][N:57]([c:58]1[cH:59][cH:60][n:61][cH:62][cH:63]1)[CH3:64].[ClH:55].[O:65]=[CH:66][N:67]([CH3:68])[CH3:69].[OH:45][n:46]1[c:47]2[c:48]([cH:49][cH:50][cH:51][cH:52]2)[n:53][n:54]1>>[CH3:1][O:2][c:3]1[cH:4][c:5]([CH2:19][C:20](=[O:22])[N:37]2[CH:36]([C:35]#[C:34][c:31]3[cH:30][cH:29][c:28]([C:26]([O:25][CH2:23][CH3:24])=[O:27])[cH:33][cH:32]3)[CH2:40][CH2:39][CH2:38]2)[cH:6][cH:7][c:8]1[NH:9][C:10](=[O:11])[NH:12][c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1Participants
8
Sources & evidence
- ORD record
- ord-93bbb724590a4fc9866545e2388a9840
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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