Dimethyl Sulfoxide → HCID 16066664, compound
Reaction equation
[C:35](=[O:36])([O-:37])[O-:38].[CH3:41][S:42]([CH3:43])=[O:44].[CH3:45][CH2:46][O:47][C:48](=[O:49])[CH3:50].[Cl:1][c:2]1[n:3][c:4]([NH:18][c:19]2[n:20][cH:21][cH:22][c:23]([CH3:25])[cH:24]2)[c:5]2[c:6]([n:7]1)[c:8]([CH2:16][CH3:17])[n:9][n:10]2[CH2:11][CH2:12][O:13][CH2:14][CH3:15].[Cs+:39].[Cs+:40].[NH:26]1[CH2:27][CH2:28][CH:29]([C:30](=[O:31])[OH:32])[CH2:33][CH2:34]1.[OH2:51]>>[c:2]1([N:26]2[CH2:27][CH2:28][CH:29]([C:30](=[O:31])[OH:32])[CH2:33][CH2:34]2)[n:3][c:4]([NH:18][c:19]2[n:20][cH:21][cH:22][c:23]([CH3:25])[cH:24]2)[c:5]2[c:6]([n:7]1)[c:8]([CH2:16][CH3:17])[n:9][n:10]2[CH2:11][CH2:12][O:13][CH2:14][CH3:15]Participants
8
Sources & evidence
- ORD record
- ord-5145ba248783450da253869f8027716d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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