Water → HCID 178426689, compound
Reaction equation
[F:1][c:2]1[c:3]([C:22]2([C:29]#[N:30])[CH2:23][CH:24]([CH3:28])[O:25][CH2:26][CH2:27]2)[cH:4][cH:5][c:6]([F:21])[c:7]1[S:8][c:9]1[cH:10][cH:11][c:12](-[c:15]2[cH:16][cH:17][n:18][n:19]2[CH3:20])[cH:13][cH:14]1.[OH2:31].[S:32](=[O:33])(=[O:34])([OH:35])[OH:36]>>[F:1][c:2]1[c:3]([C:22]2([C:29]([NH2:30])=[O:31])[CH2:23][CH:24]([CH3:28])[O:25][CH2:26][CH2:27]2)[cH:4][cH:5][c:6]([F:21])[c:7]1[S:8][c:9]1[cH:10][cH:11][c:12](-[c:15]2[cH:16][cH:17][n:18][n:19]2[CH3:20])[cH:13][cH:14]1Participants
4
Sources & evidence
- ORD record
- ord-b196c8ab45654c76ab02b1bc9d71d85a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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