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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1692563Generated: November 1, 2026

2-Aminothiophenol → 2-[(e)-2-Amino-1-eth-(e)-ylidene-but-2-enylsulfanyl]-5-fluoro-benzoic acid methyl ester

https://huagongshe.com/reaction/1692563

Reaction equation

Participants

RoleNameHCIDCharge
Reactant2-AminothiophenolHCID 8713—
ReactantMethyl 2,5-difluorobenzoateHCID 2779364—
Product2-[(e)-2-Amino-1-eth-(e)-ylidene-but-2-enylsulfanyl]-5-fluoro-benzoic acid methyl esterHCID 87260731—

Reaction Steps

Thus, 2-aminobenzenethiol may be reacted with 2,5-difluoro-benzoic acid methyl ester to form a 2-[(E)-2-amino-1-eth-(E)-ylidene-but-2-enylsulfanyl]-5-fluoro-benzoic acid methyl ester intermediate that can be converted by treatment with alkali to 2-[(E)-2-amino-1-eth-(E)-ylidene-but-2-enylsulfanyl]-5-fluoro-benzoic acid. The benzoic acid can be cyclized to form 2-fluoro-10H-dibenzo[b,f][1,4]thiazepin-11-one, that may be converted to 11-chloro-2-fluoro-dibenzo[b,f][1,4]thiazepine, that may be further reacted with piperazine to form the title compound.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08158618B2
Source datasetuspto-grants-2012_04
ORD IDord-f8d3383a41f24282869f5a4eb8f90eda
Source noteuspto-grants-2012_04