Vitas-M small molecule compound
7-(2-chlorobenzyl)-8-(decylsulfanyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK700229
SMILES CCCCCCCCCCSc1nc2c(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 C23H31ClN4O2S MW 463.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H31ClN4O2S/c1-3-4-5-6-7-8-9-12-15-31-23-25-20-19(21(29)26-22(30)27(20)2)28(23)16-17-13-10-11-14-18(17)24/h10-11,13-14H,3-9,12,15-16H2,1-2H3,(H,26,29,30)InChIKey
BQXUIRRMNMESNI-UHFFFAOYSA-NSynonyms
331841-42-0331841420
7((2CHLOROPHENYL)METHYL)8DECYLSULFANYL3METHYLPURINE26DIONE
7((2CHLOROPHENYL)METHYL)8DECYLTHIO3METHYL137TRIHYDROPURINE26DIONE
7(2chlorobenzyl)8(decylsulfanyl)3methyl37dihydro1Hpurine26dione
7(2chlorobenzyl)8(decylthio)3methyl1Hpurine26(3H7H)dione
7(2CHLOROBENZYL)8DECYLSULFANYL3METHYL37DIHYDROPURINE26DIONE
CCCCCCCCCCSC1=NC2=C(N1CC3=CC=CC=C3Cl)C(=O)NC(=O)N2C
CCCCCCCCCCSc1nc2c(n1Cc1ccccc1Cl)c(=O)(nH)c(=O)n2C
InChI=1SC23H31ClN4O2Sc1345678912153123252019(21(29)2622(30)27(20)2)28(23)16171310111418(17)24h10111314H39121516H212H3(H262930)
MFCD01051713
ZINC000008424634
ZINC8424634
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