Dimethyl Sulfoxide → HCID 59469442, compound
Reaction equation
[Br:1][c:2]1[c:3]([CH2:27][CH3:28])[n:4][c:5]([CH2:24][CH2:25][CH3:26])[n:6]([CH2:9][c:10]2[cH:11][cH:12][c:13](-[c:16]3[c:17]([C:22]#[N:23])[cH:18][cH:19][cH:20][cH:21]3)[cH:14][cH:15]2)[c:7]1=[O:8].[CH3:44][S:45](=[O:46])[CH3:47].[CH3:48][CH2:49][O:50][C:51](=[O:52])[CH3:53].[K+:43].[OH-:42].[OH:29][CH2:30][C:31]([O:32][c:33]1[cH:34][cH:35][c:36]([OH:39])[cH:37][cH:38]1)([CH3:40])[CH3:41]>>[c:2]1([O:39][c:36]2[cH:35][cH:34][c:33]([O:32][C:31]([CH2:30][OH:29])([CH3:40])[CH3:41])[cH:38][cH:37]2)[c:3]([CH2:27][CH3:28])[n:4][c:5]([CH2:24][CH2:25][CH3:26])[n:6]([CH2:9][c:10]2[cH:11][cH:12][c:13](-[c:16]3[c:17]([C:22]#[N:23])[cH:18][cH:19][cH:20][cH:21]3)[cH:14][cH:15]2)[c:7]1=[O:8]Participants
7
Sources & evidence
- ORD record
- ord-16a5f9c170a34e059441f47417f39396
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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