Toluene → HCID 66958824, compound
Reaction equation
[CH2:1]([CH3:2])[n:3]1[n:4][c:5]([C:21](=[O:22])[NH2:23])[cH:6][c:7]1[CH2:8][CH2:9][N:10]1[C:11](=[O:20])[c:12]2[c:13]([cH:16][cH:17][cH:18][cH:19]2)[C:14]1=[O:15].[CH3:28][c:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1.[S:24]([Cl:25])([Cl:26])=[O:27]>>[CH2:1]([CH3:2])[n:3]1[n:4][c:5]([C:21]#[N:23])[cH:6][c:7]1[CH2:8][CH2:9][N:10]1[C:11](=[O:20])[c:12]2[c:13]([cH:16][cH:17][cH:18][cH:19]2)[C:14]1=[O:15]Participants
4
Sources & evidence
- ORD record
- ord-acf18db7b0a74ba5ba03460c21c27760
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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