Toluene → HCID 15288193, compound
Reaction equation
[CH2:13]([Li:14])[CH2:15][CH2:16][CH3:17].[CH2:18]([Sn:19]([Cl:20])([CH2:21][CH2:22][CH2:23][CH3:24])[CH2:25][CH2:26][CH2:27][CH3:28])[CH2:29][CH2:30][CH3:31].[CH3:1][C:2]1([CH3:12])[N:3]=[C:4]([c:7]2[s:8][cH:9][cH:10][cH:11]2)[O:5][CH2:6]1.[CH3:32][C:33]1([CH3:34])[CH2:35][O:36][C:37]([c:38]2[s:39][cH:40][cH:41][c:42]2[Sn:43]([CH2:44][CH2:45][CH2:46][CH3:47])([CH2:48][CH2:49][CH2:50][CH3:51])[CH2:52][CH2:53][CH2:54][CH3:55])=[N:56]1.[CH3:68][c:69]1[cH:70][cH:71][cH:72][cH:73][cH:74]1.[N+:57](=[O:58])([O-:59])[c:60]1[c:61]([CH2:62][Br:63])[cH:64][cH:65][cH:66][cH:67]1>>[CH3:1][C:2]1([CH3:12])[N:3]=[C:4]([c:7]2[s:8][cH:9][cH:10][c:11]2[CH2:62][c:61]2[c:60]([N+:57](=[O:58])[O-:59])[cH:67][cH:66][cH:65][cH:64]2)[O:5][CH2:6]1Participants
7
Sources & evidence
- ORD record
- ord-95480bca6e2f449c8d52ebbed2359477
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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