Vitas-M small molecule compound

7-benzyl-8-(dodecylsulfanyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK529082
SMILES CCCCCCCCCCCCSc1nc2c(n1Cc1ccccc1)c(=O)[nH]c(=O)n2C

Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.

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 C25H36N4O2S MW 456.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H36N4O2S/c1-3-4-5-6-7-8-9-10-11-15-18-32-25-26-22-21(23(30)27-24(31)28(22)2)29(25)19-20-16-13-12-14-17-20/h12-14,16-17H,3-11,15,18-19H2,1-2H3,(H,27,30,31)
InChIKey
NTIFCVKMZOGYNE-UHFFFAOYSA-N
Synonyms
328071-62-1
328071621
7benzyl8(dodecylsulfanyl)3methyl37dihydro1Hpurine26dione
7benzyl8(dodecylthio)3methyl1Hpurine26(3H7H)dione
7BENZYL8DODECYLSULFANYL3METHYL37DIHYDROPURINE26DIONE
7BENZYL8DODECYLSULFANYL3METHYLPURINE26DIONE
8DODECYLTHIO3METHYL7BENZYL137TRIHYDROPURINE26DIONE
CCCCCCCCCCCCSC1=NC2=C(N1CC3=CC=CC=C3)C(=O)NC(=O)N2C
CCCCCCCCCCCCSc1nc2c(n1Cc1ccccc1)c(=O)(nH)c(=O)n2C
InChI=1SC25H36N4O2Sc13456789101115183225262221(23(30)2724(31)28(22)2)29(25)1920161312141720h12141617H311151819H212H3(H273031)
MFCD01080078
ZINC000008398589
ZINC8398589

Check stock

See real-time availability and sample size for STK529082 on the Vitas-M platform.

Check stock on Vitas-M

Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.