Acetone → HCID 18953476, compound
Reaction equation
[Br:1].[CH2:44]([Cl:45])[Cl:46].[CH3:47][C:48](=[O:49])[CH3:50].[CH3:51][CH2:52][O:53][CH2:54][CH3:55].[CH3:56][CH2:57][N:58]([CH2:59][CH3:60])[CH2:61][CH3:62].[ClH:43].[O:21]1[CH2:22][CH2:23][N:24]([c:27]2[n:28][c:29]3[n:30]([c:31]4[cH:32][cH:33][cH:34][cH:35][c:36]24)[cH:37][n:38][c:39]3[C:40](=[O:41])[NH2:42])[CH2:25][CH2:26]1.[c:2]1([P:3]([c:4]2[cH:5][cH:6][cH:7][cH:8][cH:9]2)[c:10]2[cH:11][cH:12][cH:13][cH:14][cH:15]2)[cH:16][cH:17][cH:18][cH:19][cH:20]1>>[O:21]1[CH2:22][CH2:23][N:24]([c:27]2[n:28][c:29]3[n:30]([c:31]4[cH:32][cH:33][cH:34][cH:35][c:36]24)[cH:37][n:38][c:39]3[C:40]#[N:42])[CH2:25][CH2:26]1Participants
9
Sources & evidence
- ORD record
- ord-01c5639916ab49f392182b8c026f5fb2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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