Toluene → HCID 22936933, compound
Reaction equation
[CH3:23][c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1.[CH3:30][CH2:31][CH2:32][CH2:33][N:34]=[C:35]=[O:36].[CH3:37][C:38]#[N:39].[NH2:1][c:2]1[cH:3][cH:4][c:5]([O:6][c:7]2[cH:8][cH:9][n:10][c:11]3[cH:12][c:13]([O:19][CH3:20])[c:14]([C:17]#[N:18])[cH:15][c:16]23)[cH:21][cH:22]1>>[NH:1]([c:2]1[cH:3][cH:4][c:5]([O:6][c:7]2[cH:8][cH:9][n:10][c:11]3[cH:12][c:13]([O:19][CH3:20])[c:14]([C:17]#[N:18])[cH:15][c:16]23)[cH:21][cH:22]1)[C:35]([NH:34][CH2:33][CH2:32][CH2:31][CH3:30])=[O:36]Participants
5
Sources & evidence
- ORD record
- ord-2bb3657bc56648e989f1884dd5749615
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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