Vitas-M small molecule compound
7-(3,4-diethoxybenzyl)-8-[(2-fluorobenzyl)sulfanyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK770267
SMILES CCOc1ccc(cc1OCC)Cn1c(SCc2ccccc2F)nc2c1c(=O)n(C)c(=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 C25H27FN4O4S MW 498.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27FN4O4S/c1-5-33-19-12-11-16(13-20(19)34-6-2)14-30-21-22(28(3)25(32)29(4)23(21)31)27-24(30)35-15-17-9-7-8-10-18(17)26/h7-13H,5-6,14-15H2,1-4H3InChIKey
YVGSNRKYWIUJFT-UHFFFAOYSA-NSynonyms
7((34DIETHOXYPHENYL)METHYL)8((2FLUOROPHENYL)METHYLSULFANYL)13DIMETHYLPURINE26DIONE
7(34diethoxybenzyl)8((2fluorobenzyl)sulfanyl)13dimethyl37dihydro1Hpurine26dione
CCOC1=C(C=C(C=C1)CN2C3=C(N=C2SCC4=CC=CC=C4F)N(C(=O)N(C3=O)C)C)OCC
InChI=1SC25H27FN4O4Sc153319121116(1320(19)3462)14302122(28(3)25(32)29(4)23(21)31)2724(30)3515179781018(17)26h713H561415H214H3
MFCD03765927
ZINC000000719990
ZINC00719990
ZINC719990
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