Vitas-M small molecule compound
8-(decylsulfanyl)-7-dodecyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK700053
SMILES CCCCCCCCCCCCn1c(SCCCCCCCCCC)nc2c1c(=O)[nH]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 C28H50N4O2S MW 506.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H50N4O2S/c1-4-6-8-10-12-14-15-16-18-20-22-32-24-25(31(3)27(34)30-26(24)33)29-28(32)35-23-21-19-17-13-11-9-7-5-2/h4-23H2,1-3H3,(H,30,33,34)InChIKey
ZSYSBQRQZKWNSF-UHFFFAOYSA-NSynonyms
329706-42-5329706425
8(decylsulfanyl)7dodecyl3methyl37dihydro1Hpurine26dione
8(decylthio)7dodecyl3methyl1Hpurine26(3H7H)dione
8DECYLSULFANYL7DODECYL3METHYLPURINE26DIONE
CCCCCCCCCCCCn1c(SCCCCCCCCCC)nc2c1c(=O)(nH)c(=O)n2C
CCCCCCCCCCCCN1C2=C(N=C1SCCCCCCCCCC)N(C(=O)NC2=O)C
InChI=1SC28H50N4O2Sc14681012141516182022322425(31(3)27(34)3026(24)33)2928(32)352321191713119752h423H213H3(H303334)
MFCD01143524
ZINC000097949569
ZINC97949569
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