Dimethyl Sulfoxide → HCID 73009752, compound
Reaction equation
[CH3:35][S:36]([CH3:37])=[O:38].[Cl:1][c:2]1[n:3][c:4]([C:24]#[N:25])[n:5][c:6]([NH:17][CH:18]([C:19]([F:20])([F:21])[F:22])[CH3:23])[c:7]1-[c:8]1[c:9]([F:16])[cH:10][c:11]([F:15])[cH:12][c:13]1[F:14].[K+:26].[K+:27].[O-:28][C:29]([O-:30])=[O:31].[OH2:34].[OH:32][OH:33]>>[Cl:1][c:2]1[n:3][c:4]([C:24]([NH2:25])=[O:28])[n:5][c:6]([NH:17][CH:18]([C:19]([F:20])([F:21])[F:22])[CH3:23])[c:7]1-[c:8]1[c:9]([F:16])[cH:10][c:11]([F:15])[cH:12][c:13]1[F:14]Participants
7
Sources & evidence
- ORD record
- ord-251f455973bf4713b8626360ca90f61c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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