Vitas-M small molecule compound

ethyl [(5Z)-5-{3-bromo-4-[(4-methylbenzyl)oxy]benzylidene}-2,4-dioxo-1,3-thiazolidin-3-yl]acetate

Catalog ID
STK152419
SMILES CCOC(=O)CN1C(=O)S/C(=C\c2ccc(c(c2)Br)OCc2ccc(cc2)C)/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 C22H20BrNO5S MW 490.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20BrNO5S/c1-3-28-20(25)12-24-21(26)19(30-22(24)27)11-16-8-9-18(17(23)10-16)29-13-15-6-4-14(2)5-7-15/h4-11H,3,12-13H2,1-2H3/b19-11-
InChIKey
YHWAAWCCJAQEHS-ODLFYWEKSA-N
Synonyms

CCOC(=O)CN1C(=O)C(=CC2=CC(=C(C=C2)OCC3=CC=C(C=C3)C)Br)SC1=O
CCOC(=O)CN1C(=O)SC(=Cc2ccc(c(c2)Br)OCc2ccc(cc2)C)C1=O
ETHYL((5Z)5(3BROMO4((4METHYLBENZYL)OXY)BENZYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
ETHYL2((5Z)5((3BROMO4((4METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
InChI=1SC22H20BrNO5Sc132820(25)122421(26)19(3022(24)27)11168918(17(23)1016)2913156414(2)5715h411H31213H212H3b1911
MFCD06662868
ZINC000001139596
ZINC01139596
ZINC1139596

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Available files

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