2-(5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)acetic acid

Modify Date: 2025-08-20 18:51:45

2-(5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)acetic acid Structure
2-(5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)acetic acid structure
Common Name 2-(5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)acetic acid
CAS Number 82159-06-6 Molecular Weight 279.33500
Density N/A Boiling Point 460.4ºC at 760 mmHg
Molecular Formula C12H9NO3S2 Melting Point N/A
MSDS N/A Flash Point 232.2ºC

 Names

Name 2-(5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)acetic acid
Synonym More Synonyms

 Chemical & Physical Properties

Boiling Point 460.4ºC at 760 mmHg
Molecular Formula C12H9NO3S2
Molecular Weight 279.33500
Flash Point 232.2ºC
Exact Mass 279.00200
PSA 115.00000
LogP 1.91030
InChIKey CMANXDDFFAZWJR-TWGQIWQCSA-N
SMILES O=C(O)CN1C(=O)C(=Cc2ccccc2)SC1=S

 Safety Information

HS Code 2934999090

 Synthetic Route

~88%

2-(5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)acetic acid Structure

2-(5-benzyliden...

CAS#:82159-06-6

Literature: Frankov, I. A.; Kirillov, M. V.; Sokolova, T. N.; Skupskaya, R. V.; Kharitonovich, A. N.; Chizhevskaya, I. I. Pharmaceutical Chemistry Journal, 1985 , vol. 19, # 8 p. 544 - 547 Khimiko-Farmatsevticheskii Zhurnal, 1985 , vol. 19, # 8 p. 943 - 946

~%

2-(5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)acetic acid Structure

2-(5-benzyliden...

CAS#:82159-06-6

Literature: Andreasch Monatshefte fuer Chemie, 1908 , vol. 29, p. 402

 Precursor & DownStream

Precursor  2

DownStream  0

 Customs

HS Code 2934999090
Summary 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Bioassay

View more

Name: Inhibition of bacterial ImiS expressed in Escherichia coli BL21(DE3) at 50 uM using i...
Source: ChEMBL
Target: N/A
External Id: CHEMBL4256439
Name: Inhibition of bacterial NDM1 expressed in Escherichia coli BL21(DE3) at 50 uM using c...
Source: ChEMBL
Target: N/A
External Id: CHEMBL4256443
Name: Inhibition of bacterial L1 expressed in Escherichia coli BL21(DE3) using cefazolin as...
Source: ChEMBL
Target: N/A
External Id: CHEMBL4256442
Name: Inhibition of bacterial VIM2 expressed in Escherichia coli BL21(DE3) at 50 uM using c...
Source: ChEMBL
Target: N/A
External Id: CHEMBL4256444
Name: Cytotoxicity against human HeLa cells by alamar blue assay
Source: ChEMBL
Target: HeLa
External Id: CHEMBL954414
Name: Inhibitory activity against class C Beta-lactamase isolated from Enterobacter cloacae
Source: ChEMBL
Target: Beta-lactamase
External Id: CHEMBL652632
Name: Inhibition of Trypanosoma brucei DPMS expressed in Escherichia coli assessed as resid...
Source: ChEMBL
Target: N/A
External Id: CHEMBL954412
Name: Antitrypanosomal activity against Trypanosoma brucei 427
Source: ChEMBL
Target: Trypanosoma brucei
External Id: CHEMBL954413
Name: Inhibition of His-tagged Escherichia coli DXR at 20 uM pre-incubated for 2 mins befor...
Source: ChEMBL
Target: 1-deoxy-D-xylulose 5-phosphate reductoisomerase
External Id: CHEMBL3376289
Name: Inhibition of recombinant N-terminal His-tagged Escherichia coli TEM1 (24 to 286 resi...
Source: ChEMBL
Target: Beta-lactamase TEM
External Id: CHEMBL4121766
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 Synonyms

3-(Carboxymethyl)-5-benzylidenerhodanine
(5-Benzyliden-4-oxo-2-thioxo-thiazolidin-3-yl)-essigsaeure
(5-Benzylidene-4-oxo-2-thioxo-thiazolidin-3-yl)-acetic acid
[(5Z)-(5-benzylidene-4-oxo-2-thioxo-1,3-thiazolidin-3-yl)]acetic acid
(5-benzyliden-4-oxo-2-thioxo-thiazolidin-3-yl)-acetic acid
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