Dimethyl Sulfoxide → HCID 178523086, compound
Reaction equation
[B-:30]([F:31])([F:32])([F:33])[F:34].[CH3:52][CH2:53][N:54]([CH2:55][CH3:56])[CH2:57][CH3:58].[CH3:59][S:60]([CH3:61])=[O:62].[Cl:1][c:2]1[cH:3][c:4]([C:5](=[O:6])[NH:7][CH2:8][c:9]2[n:10][c:11]3[c:12]([nH:13]2)[cH:14][cH:15][c:16]([Cl:18])[cH:17]3)[cH:19][cH:20][c:21]1[C:22](=[O:23])[OH:24].[S:25]1[CH2:26][NH:27][CH2:28][CH2:29]1.[n:35]1([O:36][C:37]([N:38]([CH3:39])[CH3:40])=[N+:41]([CH3:42])[CH3:43])[c:44]2[cH:45][cH:46][cH:47][cH:48][c:49]2[n:50][n:51]1>>[Cl:1][c:2]1[cH:3][c:4]([C:5](=[O:6])[NH:7][CH2:8][c:9]2[n:10][c:11]3[c:12]([nH:13]2)[cH:14][cH:15][c:16]([Cl:18])[cH:17]3)[cH:19][cH:20][c:21]1[C:22](=[O:23])[N:27]1[CH2:26][S:25][CH2:29][CH2:28]1Participants
7
Sources & evidence
- ORD record
- ord-37bf2364ab3042efb7bf69ba67920f4a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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