Toluene → HCID 69458742, compound
Reaction equation
[CH3:27][N:28]1[CH2:29][CH2:30][O:31][CH2:32][CH2:33]1.[CH3:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1.[NH2:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][c:10]([NH2:17])[c:11]3[n:12]([cH:13]2)[cH:14][cH:15][n:16]3)[cH:6][cH:7]1.[c:18]1([N:24]=[C:25]=[O:26])[cH:19][cH:20][cH:21][cH:22][cH:23]1>>[NH:1]([c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][c:10]([NH2:17])[c:11]3[n:12]([cH:13]2)[cH:14][cH:15][n:16]3)[cH:6][cH:7]1)[C:25]([NH:24][c:18]1[cH:19][cH:20][cH:21][cH:22][cH:23]1)=[O:26]Participants
5
Sources & evidence
- ORD record
- ord-e71d483602944f8784584b84bbfeb434
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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