HCID 46785477, compound → HCID 86620706, compound
Reaction equation
[CH3:1][c:2]1[nH:3][c:4]2[cH:5][cH:6][c:7]([C:15]#[N:16])[c:8]([C:11]([F:12])([F:13])[F:14])[c:9]2[cH:10]1.[F:17][C:18]([c:19]1[cH:20][c:21](-[c:25]2[s:26][c:27]([CH2:30][Cl:31])[cH:28][n:29]2)[cH:22][cH:23][cH:24]1)([F:32])[F:33]>>[CH3:1][c:2]1[n:3]([CH2:30][c:27]2[s:26][c:25](-[c:21]3[cH:20][c:19]([C:18]([F:17])([F:32])[F:33])[cH:24][cH:23][cH:22]3)[n:29][cH:28]2)[c:4]2[cH:5][cH:6][c:7]([C:15]#[N:16])[c:8]([C:11]([F:12])([F:13])[F:14])[c:9]2[cH:10]1Participants
3
Sources & evidence
- ORD record
- ord-af47da6c2e81470cb174f20ea5e375a8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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