Vitas-M small molecule compound
ethyl 3-[4-methyl-9-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)-2-oxo-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-3-yl]propanoate
Catalog ID
STK631059
SMILES CCOC(=O)CCc1c(=O)oc2c(c1C)ccc1c2CN(CO1)C1(C)CCS(=O)(=O)C1
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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 C22H27NO7S MW 449.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27NO7S/c1-4-28-19(24)8-6-16-14(2)15-5-7-18-17(20(15)30-21(16)25)11-23(13-29-18)22(3)9-10-31(26,27)12-22/h5,7H,4,6,8-13H2,1-3H3InChIKey
YBDDZQUVZSOMLR-UHFFFAOYSA-NSynonyms
919740-15-1919740151
CCOC(=O)CCC1=C(C2=C(C3=C(C=C2)OCN(C3)C4(CCS(=O)(=O)C4)C)OC1=O)C
ethyl3(4methyl9(3methyl11dioxidotetrahydrothiophen3yl)2oxo28910tetrahydrochromeno(87e)(13)oxazin3yl)propanoate
ethyl3(4methyl9(3methyl11dioxidotetrahydrothiophen3yl)2oxo910dihydro2H8Hchromeno(87e)(13)oxazin3yl)propanoate
ethyl3(4methyl9(3methyl11dioxothiolan3yl)2oxo810dihydropyrano(23f)(13)benzoxazin3yl)propanoate
InChI=1SC22H27NO7Sc142819(24)861614(2)15571817(20(15)3021(16)25)1123(132918)22(3)91031(2627)1222h57H46813H213H3
MFCD08747775
ZINC000057160203
ZINC000057160204
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