Vitas-M small molecule compound
benzyl {[6-hydroxy-7-(2-methoxyethyl)-3-methyl-2-oxo-3,7-dihydro-2H-purin-8-yl]sulfanyl}acetate
Catalog ID
STK640970
SMILES COCCn1c(SCC(=O)OCc2ccccc2)nc2c1c(O)nc(=O)n2C
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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 C18H20N4O5S MW 404.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N4O5S/c1-21-15-14(16(24)20-17(21)25)22(8-9-26-2)18(19-15)28-11-13(23)27-10-12-6-4-3-5-7-12/h3-7H,8-11H2,1-2H3,(H,20,24,25)InChIKey
IKOKZITWPGSQRG-UHFFFAOYSA-NSynonyms
313470-55-2313470552
benzyl((6hydroxy7(2methoxyethyl)3methyl2oxo37dihydro2Hpurin8yl)sulfanyl)acetate
BENZYL2(7(2METHOXYETHYL)3METHYL26DIOXOPURIN8YL)SULFANYLACETATE
CN1C2=C(C(=O)NC1=O)N(C(=N2)SCC(=O)OCC3=CC=CC=C3)CCOC
InChI=1SC18H20N4O5Sc1211514(16(24)2017(21)25)22(89262)18(1915)281113(23)2710126435712h37H811H212H3(H202425)
MFCD18162509
PHENYLMETHYL2(7(2METHOXYETHYL)3METHYL26DIOXO137TRIHYDROPURIN8YLTHIO)ACETATE
ZINC000002062054
ZINC02062054
ZINC2062054
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