p-Toluenesulfonate → HCID 73855054, compound
Reaction equation
[CH2:1]([CH3:2])[NH:3][c:4]1[c:5]([N+:16]([O-:17])=[O:18])[cH:6][c:7]([NH:8][C:9]([CH2:10][O:11][CH3:12])=[O:13])[cH:14][cH:15]1.[CH2:30]([c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1)[N:37]1[CH2+:38]([S:53][CH3:54])[S:39][C:40](=[C:43]2[S:44][c:45]3[c:46]([cH:49][cH:50][cH:51][cH:52]3)[N:47]2[CH3:48])[C:41]1=[O:42].[c:19]1([CH3:20])[cH:21][cH:22][c:23]([S:24]([O-:25])(=[O:26])=[O:27])[cH:28][cH:29]1>>[CH2:1]([CH3:2])[NH:3][c:4]1[c:5]([N:16]=[C:38]2[N:37]([CH2:30][c:31]3[cH:32][cH:33][cH:34][cH:35][cH:36]3)[C:41](=[O:42])[C:40](=[C:43]3[S:44][c:45]4[c:46]([cH:49][cH:50][cH:51][cH:52]4)[N:47]3[CH3:48])[S:39]2)[cH:6][c:7]([NH:8][C:9]([CH2:10][O:11][CH3:12])=[O:13])[cH:14][cH:15]1Participants
3
Sources & evidence
- ORD record
- ord-4e2456cb8b934831bca65d30482b895f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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