Vitas-M small molecule compound
8-(azepan-1-yl)-7-[2-(1,3-benzothiazol-2-ylsulfanyl)ethyl]-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Catalog ID
STK567604
SMILES Cn1c(=O)nc(c2c1nc(n2CCSc1nc2c(s1)cccc2)N1CCCCCC1)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 C21H24N6O2S2 MW 456.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N6O2S2/c1-25-17-16(18(28)24-20(25)29)27(19(23-17)26-10-6-2-3-7-11-26)12-13-30-21-22-14-8-4-5-9-15(14)31-21/h4-5,8-9H,2-3,6-7,10-13H2,1H3,(H,24,28,29)InChIKey
BDBJYORBOCIVNI-UHFFFAOYSA-NSynonyms
501352-30-3501352303
MFCD05730060
ZINC000009375050
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