Vitas-M small molecule compound
7-(2-chlorobenzyl)-8-(dodecylsulfanyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK700132
SMILES CCCCCCCCCCCCSc1nc2c(n1Cc1ccccc1Cl)c(=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 C25H35ClN4O2S MW 491.10 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H35ClN4O2S/c1-3-4-5-6-7-8-9-10-11-14-17-33-25-27-22-21(23(31)28-24(32)29(22)2)30(25)18-19-15-12-13-16-20(19)26/h12-13,15-16H,3-11,14,17-18H2,1-2H3,(H,28,31,32)InChIKey
FFUQHSUKNUAISX-UHFFFAOYSA-NSynonyms
331841-43-1331841431
7((2CHLOROPHENYL)METHYL)8DODECYLSULFANYL3METHYLPURINE26DIONE
7((2CHLOROPHENYL)METHYL)8DODECYLTHIO3METHYL137TRIHYDROPURINE26DIONE
7(2chlorobenzyl)8(dodecylsulfanyl)3methyl37dihydro1Hpurine26dione
7(2chlorobenzyl)8(dodecylthio)3methyl1Hpurine26(3H7H)dione
7(2CHLOROBENZYL)8DODECYLSULFANYL3METHYL37DIHYDROPURINE26DIONE
CCCCCCCCCCCCSC1=NC2=C(N1CC3=CC=CC=C3Cl)C(=O)NC(=O)N2C
CCCCCCCCCCCCSc1nc2c(n1Cc1ccccc1Cl)c(=O)(nH)c(=O)n2C
InChI=1SC25H35ClN4O2Sc13456789101114173325272221(23(31)2824(32)29(22)2)30(25)18191512131620(19)26h12131516H311141718H212H3(H283132)
MFCD01051714
ZINC000008424636
ZINC8424636
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