Toluene → HCID 20779309, compound
Reaction equation
[CH3:1][O:2][C:3]([CH:4]([CH2:5][c:6]1[cH:7][cH:8][cH:9][cH:10][cH:11]1)[N:12]([CH2:13][c:14]1[cH:15][cH:16][c:17]([Sn:20]([CH2:21][CH2:22][CH2:23][CH3:24])([CH2:25][CH2:26][CH2:27][CH3:28])[CH2:29][CH2:30][CH2:31][CH3:32])[cH:18][cH:19]1)[S:33](=[O:34])(=[O:35])[c:36]1[c:37]([CH3:46])[c:38]([CH3:45])[c:39]([O:43][CH3:44])[cH:40][c:41]1[CH3:42])=[O:47].[CH3:48][O:49][C:50](=[O:51])[c:52]1[s:53][c:54]([Br:57])[cH:55][cH:56]1.[CH3:58][c:59]1[cH:60][cH:61][cH:62][cH:63][cH:64]1>>[CH3:1][O:2][C:3]([CH:4]([CH2:5][c:6]1[cH:7][cH:8][cH:9][cH:10][cH:11]1)[N:12]([CH2:13][c:14]1[cH:15][cH:16][c:17](-[c:54]2[s:53][c:52]([C:50]([O:49][CH3:48])=[O:51])[cH:56][cH:55]2)[cH:18][cH:19]1)[S:33](=[O:34])(=[O:35])[c:36]1[c:37]([CH3:46])[c:38]([CH3:45])[c:39]([O:43][CH3:44])[cH:40][c:41]1[CH3:42])=[O:47]Participants
4
Sources & evidence
- ORD record
- ord-506c834e67d3423b8b75c03dea773ba6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
Loading…