Acetate → 4-(2-Hydroxyethylsulfanyl)-3-nitrobenzenesulfonamide

HRID 306092

Reaction equation

[CH3:6][C:7](=[O:8])[O-:9].[Cl:10][c:11]1[c:12]([N+:21](=[O:22])[O-:23])[cH:13][c:14]([S:17](=[O:18])(=[O:19])[NH2:20])[cH:15][cH:16]1.[ClH:24].[Na+:5].[OH2:25].[SH:1][CH2:2][CH2:3][OH:4]>>[S:1]([CH2:2][CH2:3][OH:4])[c:11]1[c:12]([N+:21](=[O:22])[O-:23])[cH:13][c:14]([S:17](=[O:18])(=[O:19])[NH2:20])[cH:15][cH:16]1

Participants

Reactant 6

HCID 175Acetate

HCID 313Hydrochloric Acid

HCID 923Sodium ion

HCID 962Water

HCID 15672-Mercaptoethanol

HCID 73244-Chloro-3-nitrobenzenesulfonamide

Product 1

HCID 48426344-(2-Hydroxyethylsulfanyl)-3-nitrobenzenesulfonamide

Sources & evidence

ORD record: ord-43de321fb45b4562b2fe97424a9900f6
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

Linked notes

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