Vitas-M small molecule compound
8-(benzylsulfanyl)-7-dodecyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK700108
SMILES CCCCCCCCCCCCn1c(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 C25H36N4O2S MW 456.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H36N4O2S/c1-3-4-5-6-7-8-9-10-11-15-18-29-21-22(28(2)24(31)27-23(21)30)26-25(29)32-19-20-16-13-12-14-17-20/h12-14,16-17H,3-11,15,18-19H2,1-2H3,(H,27,30,31)InChIKey
PRXSTTFSWKNPLN-UHFFFAOYSA-NSynonyms
329705-59-1329705591
7DODECYL3METHYL8(PHENYLMETHYLTHIO)137TRIHYDROPURINE26DIONE
8(benzylsulfanyl)7dodecyl3methyl37dihydro1Hpurine26dione
8(benzylthio)7dodecyl3methyl1Hpurine26(3H7H)dione
8BENZYLSULFANYL7DODECYL3METHYLPURINE26DIONE
CCCCCCCCCCCCn1c(SCc2ccccc2)nc2c1c(=O)(nH)c(=O)n2C
CCCCCCCCCCCCN1C2=C(N=C1SCC3=CC=CC=C3)N(C(=O)NC2=O)C
InChI=1SC25H36N4O2Sc1345678910111518292122(28(2)24(31)2723(21)30)2625(29)321920161312141720h12141617H311151819H212H3(H273031)
MFCD01143527
ZINC000097949556
ZINC97949556
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