Toluene → HCID 178425633, compound
Reaction equation
[CH3:12][Al:13]([CH3:14])[CH3:15].[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8]([NH2:9])[cH:10][cH:11]1.[CH3:26][c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1.[CH:33]([Cl:34])([Cl:35])[Cl:36].[Cl:16][c:17]1[cH:18][c:19]([C:20]#[N:21])[cH:22][cH:23][c:24]1[CH3:25]>>[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8]([NH:9][C:20]([c:19]2[cH:18][c:17]([Cl:16])[c:24]([CH3:25])[cH:23][cH:22]2)=[NH:21])[cH:10][cH:11]1Participants
6
Sources & evidence
- ORD record
- ord-d5176b63948d448dac55f5dd887a185d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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