Sodium ion → 5-Chloro-4-(2,6-dichloroanilino)-3-thiophenacetonitrile

HRID 301367Notes

Reaction equation

HRID 301367 reaction equation
[CH2:33]([Cl:34])[Cl:35].[Cl:6][c:7]1[c:8]([NH:9][c:10]2[c:11]([CH2:15][C:16]#[N:17])[cH:12][s:13][cH:14]2)[c:18]([Cl:22])[cH:19][cH:20][cH:21]1.[Na+:29].[Na+:30].[Na+:32].[OH-:31].[S:1]([Cl:2])(=[O:3])([Cl:4])=[O:5].[S:23]([S:24]([O-:25])=[O:26])([O-:27])=[O:28]>>[Cl:4][c:14]1[c:10]([NH:9][c:8]2[c:7]([Cl:6])[cH:21][cH:20][cH:19][c:18]2[Cl:22])[c:11]([CH2:15][C:16]#[N:17])[cH:12][s:13]1

Participants

7

Reactant 6

HCID 923Sodium ion3×HCID 961HydroxideHCID 1086DithioniteHCID 6344DichloromethaneHCID 24648Sulfuryl chlorideHCID 23457191HCID 23457191, compound

Product 1

HCID 234572395-Chloro-4-(2,6-dichloroanilino)-3-thiophenacetonitrile

Sources & evidence

ORD record
ord-b6466bbc70cf430eb8bcaf9f82b8d5f8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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