Vitas-M small molecule compound
4-[(E)-{2-[7-(4-fluorobenzyl)-6-hydroxy-3-methyl-2-oxo-3,7-dihydro-2H-purin-9-ium-8-yl]hydrazinylidene}methyl]phenolate
Catalog ID
STK585725
SMILES [O-]c1ccc(cc1)/C=N/Nc1[nH+]c2c(n1Cc1ccc(cc1)F)c(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 C20H17FN6O3 MW 408.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17FN6O3/c1-26-17-16(18(29)24-20(26)30)27(11-13-2-6-14(21)7-3-13)19(23-17)25-22-10-12-4-8-15(28)9-5-12/h2-10,28H,11H2,1H3,(H,23,25)(H,24,29,30)/b22-10+InChIKey
DWRZYASXFCFWBD-LSHDLFTRSA-NSynonyms
877796-51-5(O)c1ccc(cc1)C=NNc1(nH+)c2c(n1Cc1ccc(cc1)F)c(O)nc(=O)n2C
4((E)(2(7(4fluorobenzyl)6hydroxy3methyl2oxo37dihydro2Hpurin9ium8yl)hydrazinylidene)methyl)phenolate
877796515
MFCD07204141
ZINC000005460995
Check stock
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