Vitas-M small molecule compound
2-{[2-ethoxy-4-({2-[4-(methylsulfanyl)phenyl]-4,6-dioxo-1,3-dioxan-5-ylidene}methyl)phenoxy]methyl}benzonitrile
Catalog ID
STL025920
SMILES CCOc1cc(ccc1OCc1ccccc1C#N)/C=C/1\C(=O)OC(OC1=O)c1ccc(cc1)SC
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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 C28H23NO6S MW 501.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23NO6S/c1-3-32-25-15-18(8-13-24(25)33-17-21-7-5-4-6-20(21)16-29)14-23-26(30)34-28(35-27(23)31)19-9-11-22(36-2)12-10-19/h4-15,28H,3,17H2,1-2H3/b23-14-InChIKey
BVZUVOSGZBFSSM-UCQKPKSFSA-NSynonyms
724748-59-82((2ethoxy4((2(4(methylsulfanyl)phenyl)46dioxo13dioxan5ylidene)methyl)phenoxy)methyl)benzonitrile
2((2ethoxy4((2(4(methylthio)phenyl)46dioxo13dioxan5ylidene)methyl)phenoxy)methyl)benzonitrile
724748598
CCOc1cc(ccc1OCc1ccccc1C#N)C=C1C(=O)OC(OC1=O)c1ccc(cc1)SC
MFCD03674691
ZINC000002213454
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