Toluene → HCID 178516287, compound
Reaction equation
[CH3:27][c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1.[CH3:41][CH2:42][N:43]([CH2:44][CH3:45])[CH2:46][CH3:47].[CH3:48][CH2:49][O:50][CH2:51][CH3:52].[NH2:1][CH2:2][c:3]1[cH:4][c:5]([NH:9][c:10]2[n:11][nH:12][c:13]3[n:14][cH:15][n:16][c:17]([NH:19][c:20]4[cH:21][c:22]([Cl:26])[cH:23][cH:24][cH:25]4)[c:18]23)[cH:6][cH:7][cH:8]1.[O:34]=[C:35]1[CH2:36][CH2:37][C:38](=[O:39])[O:40]1>>[N:1]1([CH2:2][c:3]2[cH:4][c:5]([NH:9][c:10]3[n:11][nH:12][c:13]4[n:14][cH:15][n:16][c:17]([NH:19][c:20]5[cH:21][c:22]([Cl:26])[cH:23][cH:24][cH:25]5)[c:18]34)[cH:6][cH:7][cH:8]2)[C:35](=[O:34])[CH2:36][CH2:37][C:38]1=[O:39]Participants
6
Sources & evidence
- ORD record
- ord-7a70e4cb77dd42ca96facbb5bbb25f47
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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