Benzene → 3-(5-(methylthio)-1,3,4-thiadiazol-2-ylthio)pyrazine-2-carbonitrile
Reaction equation
[CH3:1][S:2][c:3]1[n:4][n:5][c:6]([SH:8])[s:7]1.[Cl:11][c:12]1[c:13]([C:18]#[N:19])[n:14][cH:15][cH:16][n:17]1.[H-:10].[Na+:9].[O:20]=[CH:21][N:22]([CH3:23])[CH3:24].[cH:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1>>[CH3:1][S:2][c:3]1[n:4][n:5][c:6]([S:8][c:12]2[c:13]([C:18]#[N:19])[n:14][cH:15][cH:16][n:17]2)[s:7]1Participants
7
Sources & evidence
- ORD record
- ord-6741e16d37954cf4bb06eb04bf9acb2c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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