Vitas-M small molecule compound
(5E)-5-{3-bromo-5-ethoxy-4-[2-(3-methylphenoxy)ethoxy]benzylidene}-3-methyl-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK078772
SMILES CCOc1cc(/C=C\2/SC(=S)N(C2=O)C)cc(c1OCCOc1cccc(c1)C)Br
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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 C22H22BrNO4S2 MW 508.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22BrNO4S2/c1-4-26-18-12-15(13-19-21(25)24(3)22(29)30-19)11-17(23)20(18)28-9-8-27-16-7-5-6-14(2)10-16/h5-7,10-13H,4,8-9H2,1-3H3/b19-13+InChIKey
KNVWVCVMHSKJJO-CPNJWEJPSA-NSynonyms
(5E)5((3BROMO5ETHOXY4(2(3METHYLPHENOXY)ETHOXY)PHENYL)METHYLIDENE)3METHYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(5E)5(3BROMO5ETHOXY4(2(3METHYLPHENOXY)ETHOXY)BENZYLIDENE)3METHYL2THIOXO13THIAZOLIDIN4ONE
CCOC1=C(C(=CC(=C1)C=C2C(=O)N(C(=S)S2)C)Br)OCCOC3=CC=CC(=C3)C
CCOc1cc(C=C2SC(=S)N(C2=O)C)cc(c1OCCOc1cccc(c1)C)Br
InChI=1SC22H22BrNO4S2c1426181215(131921(25)24(3)22(29)3019)1117(23)20(18)2898271675614(2)1016h571013H489H213H3b1913+
MFCD02121960
STK078772
ZINC000002958136
ZINC02958136
ZINC2958136
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