Vitas-M small molecule compound

1,3-dimethyl-8-[(4-methylbenzyl)sulfanyl]-7-pentyl-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK541058
SMILES CCCCCn1c(SCc2ccc(cc2)C)nc2c1c(=O)n(c(=O)n2C)C

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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/c1-5-6-7-12-24-16-17(22(3)20(26)23(4)18(16)25)21-19(24)27-13-15-10-8-14(2)9-11-15/h8-11H,5-7,12-13H2,1-4H3
InChIKey
QSZVXRPUSDCQOS-UHFFFAOYSA-N
Synonyms
384801-66-5
13dimethyl8((4methylbenzyl)sulfanyl)7pentyl37dihydro1Hpurine26dione
13dimethyl8((4methylbenzyl)thio)7pentyl1Hpurine26(3H7H)dione
13DIMETHYL8((4METHYLPHENYL)METHYLSULFANYL)7PENTYLPURINE26DIONE
384801665
CCCCCN1C2=C(N=C1SCC3=CC=C(C=C3)C)N(C(=O)N(C2=O)C)C
InChI=1SC20H26N4O2Sc156712241617(22(3)20(26)23(4)18(16)25)2119(24)27131510814(2)91115h811H571213H214H3
MFCD03284495
ZINC000013551889
ZINC13551889

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Available files

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