Vitas-M small molecule compound
8,8'-(ethane-1,2-diyldisulfanediyl)bis(3-methyl-7-propyl-3,7-dihydro-1H-purine-2,6-dione)
Catalog ID
STK093743
SMILES CCCn1c(SCCSc2nc3c(n2CCC)c(=O)[nH]c(=O)n3C)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 C20H26N8O4S2 MW 506.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N8O4S2/c1-5-7-27-11-13(25(3)17(31)23-15(11)29)21-19(27)33-9-10-34-20-22-14-12(28(20)8-6-2)16(30)24-18(32)26(14)4/h5-10H2,1-4H3,(H,23,29,31)(H,24,30,32)InChIKey
XDCIJOXMVRJOKL-UHFFFAOYSA-NSynonyms
330829-01-1330829011
3METHYL8(2(3METHYL26DIOXO7PROPYLPURIN8YL)SULFANYLETHYLSULFANYL)7PROPYLPURINE26DIONE
88(ethane12diylbis(sulfanediyl))bis(3methyl7propyl1Hpurine26(3H7H)dione)
88(ETHANE12DIYLDISULFANEDIYL)BIS(3METHYL7PROPYL37DIHYDRO1HPURINE26DIONE)
CCCn1c(SCCSc2nc3c(n2CCC)c(=O)(nH)c(=O)n3C)nc2c1c(=O)(nH)c(=O)n2C
CCCN1C2=C(N=C1SCCSC3=NC4=C(N3CCC)C(=O)NC(=O)N4C)N(C(=O)NC2=O)C
InChI=1SC20H26N8O4S2c157271113(25(3)17(31)2315(11)29)2119(27)339103420221412(28(20)862)16(30)2418(32)26(14)4h510H214H3(H232931)(H243032)
MFCD01032074
STK093743
ZINC000006162553
ZINC06162553
ZINC6162553
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