N-methyl-2-pyrrolidone → HCID 58203735, compound
Reaction equation
[CH3:36][N:37]1[CH2:38][CH2:39][NH:40][CH2:41][CH2:42]1.[CH3:43][N:44]1[CH2:45][CH2:46][CH2:47][C:48]1=[O:49].[F:1][c:2]1[c:3](-[n:9]2[n:10][cH:11][n:12][c:13]2-[c:14]2[cH:15][c:16]3[c:22]([s:23]2)-[c:21]2[c:20]([cH:27][cH:26][c:25](-[c:28]4[cH:29][n:30][c:31]([F:35])[c:32]([CH3:34])[cH:33]4)[n:24]2)[O:19][CH2:18][CH2:17]3)[cH:4][cH:5][c:6]([F:8])[cH:7]1>>[F:1][c:2]1[c:3](-[n:9]2[n:10][cH:11][n:12][c:13]2-[c:14]2[cH:15][c:16]3[c:22]([s:23]2)-[c:21]2[c:20]([cH:27][cH:26][c:25](-[c:28]4[cH:29][n:30][c:31]([N:40]5[CH2:39][CH2:38][N:37]([CH3:36])[CH2:42][CH2:41]5)[c:32]([CH3:34])[cH:33]4)[n:24]2)[O:19][CH2:18][CH2:17]3)[cH:4][cH:5][c:6]([F:8])[cH:7]1Participants
4
Sources & evidence
- ORD record
- ord-9055d1622e6e4df88ff3e4dbf50457c4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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