Dichloromethane → HCID 22242752, compound
Reaction equation
[CH2:45]([Cl:46])[Cl:47].[CH3:33][S:34]([Cl:35])(=[O:36])=[O:37].[CH3:38][CH2:39][N:40]([CH2:41][CH3:42])[CH2:43][CH3:44].[OH:1][CH:2]1[CH2:3][N:4]([c:6]2[s:7][cH:8][c:9]([C:11]([N:12]([CH2:13][CH2:14][NH:15][C:16](=[O:17])[O:18][CH2:19][c:20]3[cH:21][cH:22][c:23]([N+:26](=[O:27])[O-:28])[cH:24][cH:25]3)[CH:29]([CH3:30])[CH3:31])=[O:32])[n:10]2)[CH2:5]1>>[O:1]([CH:2]1[CH2:3][N:4]([c:6]2[s:7][cH:8][c:9]([C:11]([N:12]([CH2:13][CH2:14][NH:15][C:16](=[O:17])[O:18][CH2:19][c:20]3[cH:21][cH:22][c:23]([N+:26](=[O:27])[O-:28])[cH:24][cH:25]3)[CH:29]([CH3:30])[CH3:31])=[O:32])[n:10]2)[CH2:5]1)[S:34]([CH3:33])(=[O:36])=[O:37]Participants
5
Sources & evidence
- ORD record
- ord-53af4ace830f442bb3d6e4b372b8e35c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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