N-methyl-2-pyrrolidone → HCID 69066824, compound
Reaction equation
[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[n:6][cH:7][cH:8][c:9]([N:11]2[C:12]3=[N:21][C:20]([c:22]4[cH:23][cH:24][cH:25][cH:26][cH:27]4)=[CH:19][CH2:18][N:13]3[C:14](=[O:17])[CH2:15][CH2:16]2)[n:10]1.[CH3:46][N:47]1[CH2:48][CH2:49][CH2:50][C:51]1=[O:52].[NH2:28][CH:29]([CH2:30][c:31]1[cH:32][cH:33][c:34]([CH2:37][OH:38])[cH:35][cH:36]1)[CH3:39].[O:40]1[CH2:41][CH2:42][O:43][CH2:44][CH2:45]1>>[c:5]1([NH:28][CH:29]([CH2:30][c:31]2[cH:32][cH:33][c:34]([CH2:37][OH:38])[cH:35][cH:36]2)[CH3:39])[n:6][cH:7][cH:8][c:9]([N:11]2[C:12]3=[N:21][C:20]([c:22]4[cH:23][cH:24][cH:25][cH:26][cH:27]4)=[CH:19][CH2:18][N:13]3[C:14](=[O:17])[CH2:15][CH2:16]2)[n:10]1Participants
5
Sources & evidence
- ORD record
- ord-bbc9edb4cfeb4d179d5aed17b833dacd
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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