Acetone → HCID 53713961, compound
Reaction equation
[C:38](#[N:39])[c:40]1[cH:41][c:42]([CH2:43][Br:44])[cH:45][cH:46][cH:47]1.[CH3:48][C:49](=[O:50])[CH3:51].[K+:32].[K+:33].[N:1]1([c:7]2[cH:8][c:9]([NH:13][C:14](=[O:15])[c:16]3[c:17](-[c:22]4[cH:23][cH:24][c:25]([C:28]([F:29])([F:30])[F:31])[cH:26][cH:27]4)[cH:18][cH:19][cH:20][cH:21]3)[cH:10][cH:11][cH:12]2)[CH2:2][CH2:3][NH:4][CH2:5][CH2:6]1.[O-:34][C:35]([O-:36])=[O:37]>>[N:1]1([c:7]2[cH:8][c:9]([NH:13][C:14](=[O:15])[c:16]3[c:17](-[c:22]4[cH:23][cH:24][c:25]([C:28]([F:29])([F:30])[F:31])[cH:26][cH:27]4)[cH:18][cH:19][cH:20][cH:21]3)[cH:10][cH:11][cH:12]2)[CH2:2][CH2:3][N:4]([CH2:43][c:42]2[cH:41][c:40]([C:38]#[N:39])[cH:47][cH:46][cH:45]2)[CH2:5][CH2:6]1Participants
6
Sources & evidence
- ORD record
- ord-6fd6c9ec7745480ca8550de0601107bc
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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