Cyanide → 3-Cyano-8-nitrodibenzo[b,f]thiepin
Reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:19]1)[S:7][c:8]1[c:9]([cH:12][c:13]([N+:16](=[O:17])[O-:18])[cH:14][cH:15]1)[CH:10]=[CH:11]2.[C-:20]#[N:21]>>[c:2]1([C:20]#[N:21])[cH:3][cH:4][c:5]2[c:6]([cH:19]1)[S:7][c:8]1[c:9]([cH:12][c:13]([N+:16](=[O:17])[O-:18])[cH:14][cH:15]1)[CH:10]=[CH:11]2Participants
3
Sources & evidence
- ORD record
- ord-1bb3ecb01dc942159fc2e165d0af7a06
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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