Vitas-M small molecule compound
3-(4-hydroxy-3-methoxyphenyl)-3-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)-N-{3-(methylsulfanyl)-1-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]propyl}propanamide
Catalog ID
STL550349
SMILES CSCCC(c1onc(n1)C(C)C)NC(=O)CC(c1oc(C)cc(=O)c1O)c1ccc(c(c1)OC)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 C25H31N3O7S MW 517.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N3O7S/c1-13(2)24-27-25(35-28-24)17(8-9-36-5)26-21(31)12-16(15-6-7-18(29)20(11-15)33-4)23-22(32)19(30)10-14(3)34-23/h6-7,10-11,13,16-17,29,32H,8-9,12H2,1-5H3,(H,26,31)InChIKey
HXXSCINOENORKR-UHFFFAOYSA-NSynonyms
127252693
3(4hydroxy3methoxyphenyl)3(3hydroxy6methyl4oxo4Hpyran2yl)N(1(3isopropyl124oxadiazol5yl)3(methylthio)propyl)propanamide
3(4hydroxy3methoxyphenyl)3(3hydroxy6methyl4oxo4Hpyran2yl)N(3(methylsulfanyl)1(3(propan2yl)124oxadiazol5yl)propyl)propanamide
3(4hydroxy3methoxyphenyl)3(3hydroxy6methyl4oxopyran2yl)~(N)(3methylsulfanyl1(3propan2yl124oxadiazol5yl)propyl)propanamide
InChI=1SC25H31N3O7Sc113(2)242725(352824)17(89365)2621(31)1216(156718(29)20(1115)334)2322(32)19(30)1014(3)3423h6710111316172932H8912H215H3(H2631)
MFCD31757539
ZINC000604404496
ZINC000604404500
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