Vitas-M small molecule compound

ethyl [(5E)-5-{3-chloro-4-[(4-fluorobenzyl)oxy]-5-methoxybenzylidene}-2,4-dioxo-1,3-thiazolidin-3-yl]acetate

Catalog ID
STK152427
SMILES CCOC(=O)CN1C(=O)S/C(=C/c2cc(Cl)c(c(c2)OC)OCc2ccc(cc2)F)/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 C22H19ClFNO6S MW 479.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19ClFNO6S/c1-3-30-19(26)11-25-21(27)18(32-22(25)28)10-14-8-16(23)20(17(9-14)29-2)31-12-13-4-6-15(24)7-5-13/h4-10H,3,11-12H2,1-2H3/b18-10+
InChIKey
DZBHVIOEJZRHSQ-VCHYOVAHSA-N
Synonyms

CCOC(=O)CN1C(=O)C(=CC2=CC(=C(C(=C2)Cl)OCC3=CC=C(C=C3)F)OC)SC1=O
CCOC(=O)CN1C(=O)SC(=Cc2cc(Cl)c(c(c2)OC)OCc2ccc(cc2)F)C1=O
ETHYL((5E)5(3CHLORO4((4FLUOROBENZYL)OXY)5METHOXYBENZYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
ETHYL2((5E)5((3CHLORO4((4FLUOROPHENYL)METHOXY)5METHOXYPHENYL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
InChI=1SC22H19ClFNO6Sc133019(26)112521(27)18(3222(25)28)1014816(23)20(17(914)292)3112134615(24)7513h410H31112H212H3b1810+
MFCD03706625
ZINC000006491893
ZINC06491893
ZINC6491893

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Available files

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