Vitas-M small molecule compound
7-[2-(1,3-benzothiazol-2-ylsulfanyl)ethyl]-6-hydroxy-3-methyl-8-(3-methylpiperidin-1-yl)-3,7-dihydro-2H-purin-2-one
Catalog ID
STK590535
SMILES CC1CCCN(C1)c1nc2c(n1CCSc1nc3c(s1)cccc3)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 C21H24N6O2S2 MW 456.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N6O2S2/c1-13-6-5-9-26(12-13)19-23-17-16(18(28)24-20(29)25(17)2)27(19)10-11-30-21-22-14-7-3-4-8-15(14)31-21/h3-4,7-8,13H,5-6,9-12H2,1-2H3,(H,24,28,29)InChIKey
WSYJBEPSKWALCN-UHFFFAOYSA-NSynonyms
850914-18-0850914180
MFCD07197427
ZINC000009156794
ZINC000009156795
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