Benzene → 6,11-Dihydrodibenzo[b,e]thiepine-11-carbonitrile
Reaction equation
[Cl:1][CH:2]1[c:3]2[c:4]([cH:13][cH:14][cH:15][cH:16]2)[S:5][CH2:6][c:7]2[c:8]1[cH:9][cH:10][cH:11][cH:12]2.[Cu:17][C:18]#[N:19].[cH:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1>>[CH:2]1([C:18]#[N:19])[c:3]2[c:4]([cH:13][cH:14][cH:15][cH:16]2)[S:5][CH2:6][c:7]2[c:8]1[cH:9][cH:10][cH:11][cH:12]2Participants
4
Sources & evidence
- ORD record
- ord-bcd922c137e644e5ab72ff527a7d3a16
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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