Vitas-M small molecule compound
8-(benzylsulfanyl)-7-heptyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK528768
SMILES CCCCCCCn1c(SCc2ccccc2)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 C20H26N4O2S MW 386.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N4O2S/c1-3-4-5-6-10-13-24-16-17(23(2)19(26)22-18(16)25)21-20(24)27-14-15-11-8-7-9-12-15/h7-9,11-12H,3-6,10,13-14H2,1-2H3,(H,22,25,26)InChIKey
HQTSLTKRIBHVIG-UHFFFAOYSA-NSynonyms
331675-18-4331675184
7HEPTYL3METHYL8(PHENYLMETHYLTHIO)137TRIHYDROPURINE26DIONE
8(benzylsulfanyl)7heptyl3methyl37dihydro1Hpurine26dione
8(benzylthio)7heptyl3methyl1Hpurine26(3H7H)dione
8BENZYLSULFANYL7HEPTYL3METHYL37DIHYDROPURINE26DIONE
8BENZYLSULFANYL7HEPTYL3METHYLPURINE26DIONE
CCCCCCCn1c(SCc2ccccc2)nc2c1c(=O)(nH)c(=O)n2C
CCCCCCCN1C2=C(N=C1SCC3=CC=CC=C3)N(C(=O)NC2=O)C
InChI=1SC20H26N4O2Sc134561013241617(23(2)19(26)2218(16)25)2120(24)271415118791215h791112H36101314H212H3(H222526)
MFCD00809854
ZINC000008397425
ZINC08397425
ZINC8397425
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