Benzene → 3-(5-(isopropylthio)-4-methyl-4H-1,2,4-triazol-3-ylthio)pyrazine-2-carbonitrile

HRID 143148

Reaction equation

HRID 143148 reaction equation
[CH:1]([CH3:2])([CH3:3])[S:4][c:5]1[n:6]([CH3:11])[c:7]([SH:10])[n:8][n:9]1.[Cl:14][c:15]1[c:16]([C:21]#[N:22])[n:17][cH:18][cH:19][n:20]1.[H-:13].[Na+:12].[O:23]=[CH:24][N:25]([CH3:26])[CH3:27].[cH:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1>>[CH:1]([CH3:2])([CH3:3])[S:4][c:5]1[n:6]([CH3:11])[c:7]([S:10][c:15]2[c:16]([C:21]#[N:22])[n:17][cH:18][cH:19][n:20]2)[n:8][n:9]1

Participants

7

Reactant 6

HCID 241BenzeneHCID 923Sodium ionHCID 6228DimethylformamideHCID 166653HydrideHCID 2924653-Chloropyrazine-2-carbonitrileHCID 178460819HCID 178460819, compound

Product 1

HCID 584027903-(5-(isopropylthio)-4-methyl-4H-1,2,4-triazol-3-ylthio)pyrazine-2-carbonitrile

Sources & evidence

ORD record
ord-83b20d390f2742b3815313f83612fbe1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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