1,2-Dichloroethane → HCID 178446778, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH:8]([CH2:9][CH:10]([CH3:11])[CH3:12])[C:13]([NH:14][CH:15]1[CH:16]([OH:22])[CH2:17][NH:18][CH2:19][CH2:20][CH2:21]1)=[O:23])=[O:24].[Cl:25][c:26]1[cH:27][c:28]([S:32](=[O:33])(=[O:34])[Cl:35])[cH:29][cH:30][cH:31]1.[Cl:36][CH2:37][CH2:38][Cl:39]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH:8]([CH2:9][CH:10]([CH3:11])[CH3:12])[C:13]([NH:14][CH:15]1[CH:16]([OH:22])[CH2:17][N:18]([S:32]([c:28]2[cH:27][c:26]([Cl:25])[cH:31][cH:30][cH:29]2)(=[O:33])=[O:34])[CH2:19][CH2:20][CH2:21]1)=[O:23])=[O:24]Participants
4
Sources & evidence
- ORD record
- ord-433e9f983f71438db34faeb376349cbd
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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