Vitas-M small molecule compound
(5E)-5-{[5-(4-bromo-3-chlorophenyl)furan-2-yl]methylidene}-3-(4-methoxybenzyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STL417049
SMILES COc1ccc(cc1)CN1C(=S)S/C(=C/c2ccc(o2)c2ccc(c(c2)Cl)Br)/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 C22H15BrClNO3S2 MW 520.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15BrClNO3S2/c1-27-15-5-2-13(3-6-15)12-25-21(26)20(30-22(25)29)11-16-7-9-19(28-16)14-4-8-17(23)18(24)10-14/h2-11H,12H2,1H3/b20-11+InChIKey
NHKRUWMBOQPHQV-RGVLZGJSSA-NSynonyms
(5E)5((5(4BROMO3CHLOROPHENYL)FURAN2YL)METHYLIDENE)3((4METHOXYPHENYL)METHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5E)5((5(4bromo3chlorophenyl)furan2yl)methylidene)3(4methoxybenzyl)2thioxo13thiazolidin4one
COC1=CC=C(C=C1)CN2C(=O)C(=CC3=CC=C(O3)C4=CC(=C(C=C4)Br)Cl)SC2=S
COc1ccc(cc1)CN1C(=S)SC(=Cc2ccc(o2)c2ccc(c(c2)Cl)Br)C1=O
InChI=1SC22H15BrClNO3S2c127155213(3615)122521(26)20(3022(25)29)11167919(2816)144817(23)18(24)1014h211H12H21H3b2011+
MFCD04084127
ZINC000101094901
ZINC101094901
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