Vitas-M small molecule compound
3-benzyl-7-[2-(diethylammonio)ethyl]-6-hydroxy-2-oxo-3,7-dihydro-2H-purin-9-ium
Catalog ID
STL553191
SMILES CC[NH+](CCn1c[nH+]c2c1c(O)nc(=O)n2Cc1ccccc1)CC
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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 C18H25N5O2 MW 343.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23N5O2/c1-3-21(4-2)10-11-22-13-19-16-15(22)17(24)20-18(25)23(16)12-14-8-6-5-7-9-14/h5-9,13H,3-4,10-12H2,1-2H3,(H,20,24,25)/p+2InChIKey
KWNVJQWGGAWZAY-UHFFFAOYSA-PSynonyms
2(3benzyl26dioxo9~(H)purin7ium7yl)ethyldiethylazanium
2(3BENZYL26DIOXO9HPURIN7IUM7YL)ETHYLDIETHYLAZANIUM
3benzyl7(2(diethylammonio)ethyl)6hydroxy2oxo37dihydro2Hpurin9ium
5125213
InChI=1SC18H23N5O2c1321(42)10112213191615(22)17(24)2018(25)23(16)12148657914h5913H341012H212H3(H202425)p+2
ZINC000000485750
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