Vitas-M small molecule compound
8-[(2-chloro-6-fluorobenzyl)sulfanyl]-7-hexyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK541031
SMILES CCCCCCn1c(SCc2c(F)cccc2Cl)nc2c1c(=O)n(c(=O)n2C)C
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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 C20H24ClFN4O2S MW 438.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24ClFN4O2S/c1-4-5-6-7-11-26-16-17(24(2)20(28)25(3)18(16)27)23-19(26)29-12-13-14(21)9-8-10-15(13)22/h8-10H,4-7,11-12H2,1-3H3InChIKey
XWZVMCMJKAVPAU-UHFFFAOYSA-NSynonyms
8((2chloro6fluorobenzyl)sulfanyl)7hexyl13dimethyl37dihydro1Hpurine26dione
8((2chloro6fluorobenzyl)thio)7hexyl13dimethyl1Hpurine26(3H7H)dione
8((2CHLORO6FLUOROPHENYL)METHYLSULFANYL)7HEXYL13DIMETHYLPURINE26DIONE
CCCCCCN1C2=C(N=C1SCC3=C(C=CC=C3Cl)F)N(C(=O)N(C2=O)C)C
InChI=1SC20H24ClFN4O2Sc1456711261617(24(2)20(28)25(3)18(16)27)2319(26)29121314(21)981015(13)22h810H471112H213H3
MFCD02984870
ZINC000009057726
ZINC09057726
ZINC9057726
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