Vitas-M small molecule compound
2-(4-{(E)-[3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-methoxyphenoxy)-N-phenylacetamide
Catalog ID
STL419349
SMILES COc1cc(ccc1OCC(=O)Nc1ccccc1)/C=C\1/SC(=S)N(C1=O)N1C(=O)c2c(C1=O)cccc2
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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 C27H19N3O6S2 MW 545.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19N3O6S2/c1-35-21-13-16(11-12-20(21)36-15-23(31)28-17-7-3-2-4-8-17)14-22-26(34)30(27(37)38-22)29-24(32)18-9-5-6-10-19(18)25(29)33/h2-14H,15H2,1H3,(H,28,31)/b22-14+InChIKey
NLDYZPIXUYLKCR-HYARGMPZSA-NSynonyms
2(4((E)(3(13dioxo13dihydro2Hisoindol2yl)4oxo2thioxo13thiazolidin5ylidene)methyl)2methoxyphenoxy)Nphenylacetamide
2(4((E)(3(13dioxoisoindol2yl)4oxo2sulfanylidene13thiazolidin5ylidene)methyl)2methoxyphenoxy)Nphenylacetamide
COC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)N3C(=O)C4=CC=CC=C4C3=O)OCC(=O)NC5=CC=CC=C5
COc1cc(ccc1OCC(=O)Nc1ccccc1)C=C1SC(=S)N(C1=O)N1C(=O)c2c(C1=O)cccc2
InChI=1SC27H19N3O6S2c135211316(111220(21)361523(31)28177324817)142226(34)30(27(37)3822)2924(32)189561019(18)25(29)33h214H15H21H3(H2831)b2214+
MFCD03905948
ZINC000110249142
ZINC110249142
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