Dimethyl Sulfoxide → HCID 21106512, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[n:8]1[n:9][c:10]([N:14]([c:15]2[n:16][n:17]([CH:28]([CH3:29])[CH3:30])[c:18](=[O:27])[c:19]3[cH:20][c:21]([CH2:25][OH:26])[cH:22][cH:23][c:24]23)[C:31](=[O:32])[O:33][C:34]([CH3:35])([CH3:36])[CH3:37])[cH:11][c:12]1[CH3:13].[CH3:59][S:60]([CH3:61])=[O:62].[Cl+:55]([O-:56])[O-:57].[Cl:63][CH2:64][Cl:65].[I:38](=[O:39])([c:40]1[cH:41][cH:42][cH:43][cH:44][c:45]1[C:46]([OH:47])=[O:48])=[O:49].[NH2:50][S:51](=[O:52])(=[O:53])[OH:54].[Na+:58].[OH2:66]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[n:8]1[n:9][c:10]([N:14]([c:15]2[n:16][n:17]([CH:28]([CH3:29])[CH3:30])[c:18](=[O:27])[c:19]3[cH:20][c:21]([C:25](=[O:26])[OH:39])[cH:22][cH:23][c:24]23)[C:31](=[O:32])[O:33][C:34]([CH3:35])([CH3:36])[CH3:37])[cH:11][c:12]1[CH3:13]Participants
9
Sources & evidence
- ORD record
- ord-97a20a6944914111a69cbefe5d561f7f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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