Dimethyl Sulfoxide → HCID 86601359, compound
Reaction equation
[CH3:32][S:33]([CH3:34])=[O:35].[Cl:1][c:2]1[cH:3][c:4]([CH:8]([CH2:9][OH:10])[NH:11][C:12](=[O:13])[CH:14]2[CH2:15][CH2:16][N:17]([c:20]3[cH:21][c:22]([F:26])[n:23][cH:24][cH:25]3)[CH2:18][CH2:19]2)[cH:5][cH:6][cH:7]1.[NH2:27][CH:28]([CH2:29][OH:30])[CH3:31]>>[Cl:1][c:2]1[cH:3][c:4]([CH:8]([CH2:9][OH:10])[NH:11][C:12](=[O:13])[CH:14]2[CH2:15][CH2:16][N:17]([c:20]3[cH:21][c:22]([NH:27][CH:28]([CH2:29][OH:30])[CH3:31])[n:23][cH:24][cH:25]3)[CH2:18][CH2:19]2)[cH:5][cH:6][cH:7]1Participants
4
Sources & evidence
- ORD record
- ord-49f4647a23a64ec8845e9d5f58d4ada2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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