Benzene → HCID 178433217, compound
Reaction equation
[CH3:19][c:20]1[s:21][cH:22][c:23]([NH2:25])[n:24]1.[CH3:26][C:27]#[N:28].[OH2:35].[S:1]([Cl:2])([Cl:3])=[O:4].[cH:29]1[cH:30][cH:31][n:32][cH:33][cH:34]1.[cH:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1.[nH:11]1[n:12][n:13][n:14][c:15]1[C:16](=[O:17])[OH:18]>>[n:11]1[n:12][n:13][nH:14][c:15]1[C:16](=[O:18])[NH:25][c:23]1[cH:22][s:21][c:20]([CH3:19])[n:24]1Participants
8
Sources & evidence
- ORD record
- ord-24e85f9d9acf4249b8aae099aad06b92
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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