Vitas-M small molecule compound
7-({[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)-4,5,6-trimethoxy-2-benzofuran-1(3H)-one
Catalog ID
STK666540
SMILES COc1cc(ccc1OC)c1nnc(o1)SCc1c2C(=O)OCc2c(c(c1OC)OC)OC
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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 C22H22N2O8S MW 474.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O8S/c1-26-14-7-6-11(8-15(14)27-2)20-23-24-22(32-20)33-10-13-16-12(9-31-21(16)25)17(28-3)19(30-5)18(13)29-4/h6-8H,9-10H2,1-5H3InChIKey
VQUITAVHPSZDCS-UHFFFAOYSA-NSynonyms
7(((5(34dimethoxyphenyl)134oxadiazol2yl)sulfanyl)methyl)456trimethoxy2benzofuran1(3H)one
7((5(34dimethoxyphenyl)134oxadiazol2yl)sulfanylmethyl)456trimethoxy3H2benzofuran1one
COC1=C(C=C(C=C1)C2=NN=C(O2)SCC3=C(C(=C(C4=C3C(=O)OC4)OC)OC)OC)OC
InChI=1SC22H22N2O8Sc126147611(815(14)272)20232422(3220)3310131612(93121(16)25)17(283)19(305)18(13)294h68H910H215H3
MFCD09064632
ZINC000012371381
ZINC12371381
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