Vitas-M small molecule compound

4-[(5Z)-5-(2-chloro-6-fluorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoic acid

Catalog ID
STK726651
SMILES OC(=O)CCCN1C(=S)S/C(=C\c2c(F)cccc2Cl)/C1=O

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C14H11ClFNO3S2 MW 359.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H11ClFNO3S2/c15-9-3-1-4-10(16)8(9)7-11-13(20)17(14(21)22-11)6-2-5-12(18)19/h1,3-4,7H,2,5-6H2,(H,18,19)/b11-7-
InChIKey
DVBNDYCWYQBTRZ-XFFZJAGNSA-N
Synonyms
324566-96-3
(Z)4(5(2chloro6fluorobenzylidene)4oxo2thioxothiazolidin3yl)butanoicacid
324566963
4((5Z)5((2CHLORO6FLUOROPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BUTANOICACID
4((5Z)5(2chloro6fluorobenzylidene)4oxo2thioxo13thiazolidin3yl)butanoicacid
4(5((6CHLORO2FLUOROPHENYL)METHYLENE)4OXO2THIOXO13THIAZOLIDIN3YL)BUTANOICACID
C1=CC(=C(C(=C1)Cl)C=C2C(=O)N(C(=S)S2)CCCC(=O)O)F
InChI=1SC14H11ClFNO3S2c15931410(16)8(9)71113(20)17(14(21)2211)62512(18)19h1347H256H2(H1819)b117
MFCD01794243
OC(=O)CCCN1C(=S)SC(=Cc2c(F)cccc2Cl)C1=O
ZINC000002224429
ZINC2224429

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.