Isopropanol → HCID 9973027, compound
Reaction equation
[CH2:1]1[CH2:2][O:3][CH2:4][CH2:5][NH:6]1.[CH:24]([OH:25])([CH3:26])[CH3:27].[Cl:7][c:8]1[cH:9][cH:10][c:11]([NH:14][c:15]2[n:16][c:17]([C:22]#[N:23])[n:18][c:19]([F:21])[cH:20]2)[cH:12][cH:13]1>>[CH2:1]1[CH2:2][O:3][CH2:4][CH2:5][N:6]1[c:19]1[n:18][c:17]([C:22]#[N:23])[n:16][c:15]([NH:14][c:11]2[cH:10][cH:9][c:8]([Cl:7])[cH:13][cH:12]2)[cH:20]1Participants
4
Sources & evidence
- ORD record
- ord-3d29d83307b748699af0e7538553ea43
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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