N-methyl-2-pyrrolidone → HCID 57489621, compound
Reaction equation
[C:1]([NH2:2])(=[O:3])[c:4]1[c:5]([NH:11][c:12]2[cH:13][cH:14][c:15]([N:18]3[CH2:19][CH2:20][N:21]([C:24](=[O:25])[O:26][CH2:27][c:28]4[cH:29][cH:30][cH:31][cH:32][cH:33]4)[CH2:22][CH2:23]3)[cH:16][cH:17]2)[n:6][c:7]([Cl:10])[cH:8][cH:9]1.[CH3:57][N:58]1[CH2:59][CH2:60][CH2:61][C:62]1=[O:63].[CH:48]([N:49]([CH2:50][CH3:51])[CH:52]([CH3:53])[CH3:54])([CH3:55])[CH3:56].[NH:34]1[CH2:35][CH:36]([NH:40][C:41]([O:42][C:43]([CH3:44])([CH3:45])[CH3:46])=[O:47])[CH2:37][CH2:38][CH2:39]1>>[C:1]([NH2:2])(=[O:3])[c:4]1[c:5]([NH:11][c:12]2[cH:13][cH:14][c:15]([N:18]3[CH2:19][CH2:20][N:21]([C:24](=[O:25])[O:26][CH2:27][c:28]4[cH:29][cH:30][cH:31][cH:32][cH:33]4)[CH2:22][CH2:23]3)[cH:16][cH:17]2)[n:6][c:7]([N:34]2[CH2:35][CH:36]([NH:40][C:41]([O:42][C:43]([CH3:44])([CH3:45])[CH3:46])=[O:47])[CH2:37][CH2:38][CH2:39]2)[cH:8][cH:9]1Participants
5
Sources & evidence
- ORD record
- ord-3f95dd592be947e78257efb76d0dfda2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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