Vitas-M small molecule compound
8-[(4-chlorobenzyl)sulfanyl]-3-methyl-7-nonyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK699647
SMILES CCCCCCCCCn1c(SCc2ccc(cc2)Cl)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 C22H29ClN4O2S MW 449.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29ClN4O2S/c1-3-4-5-6-7-8-9-14-27-18-19(26(2)21(29)25-20(18)28)24-22(27)30-15-16-10-12-17(23)13-11-16/h10-13H,3-9,14-15H2,1-2H3,(H,25,28,29)InChIKey
GRJXUKQRXKLANL-UHFFFAOYSA-NSynonyms
331842-90-1331842901
8((4chlorobenzyl)sulfanyl)3methyl7nonyl37dihydro1Hpurine26dione
8((4chlorobenzyl)thio)3methyl7nonyl1Hpurine26(3H7H)dione
8((4CHLOROPHENYL)METHYLSULFANYL)3METHYL7NONYLPURINE26DIONE
8((4CHLOROPHENYL)METHYLTHIO)3METHYL7NONYL137TRIHYDROPURINE26DIONE
8(4CHLOROBENZYLSULFANYL)3METHYL7NONYL37DIHYDROPURINE26DIONE
CCCCCCCCCn1c(SCc2ccc(cc2)Cl)nc2c1c(=O)(nH)c(=O)n2C
CCCCCCCCCN1C2=C(N=C1SCC3=CC=C(C=C3)Cl)N(C(=O)NC2=O)C
InChI=1SC22H29ClN4O2Sc1345678914271819(26(2)21(29)2520(18)28)2422(27)301516101217(23)131116h1013H391415H212H3(H252829)
MFCD01051788
ZINC000097950515
ZINC97950515
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