Vitas-M small molecule compound
3-methyl-7-octyl-8-[(3-oxobutan-2-yl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK539783
SMILES CCCCCCCCn1c(SC(C(=O)C)C)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 C18H28N4O3S MW 380.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H28N4O3S/c1-5-6-7-8-9-10-11-22-14-15(21(4)17(25)20-16(14)24)19-18(22)26-13(3)12(2)23/h13H,5-11H2,1-4H3,(H,20,24,25)InChIKey
QOQKKJJFWNCIQU-UHFFFAOYSA-NSynonyms
371220-02-9371220029
3methyl7octyl8((3oxobutan2yl)sulfanyl)37dihydro1Hpurine26dione
3METHYL7OCTYL8((3OXOBUTAN2YL)THIO)1HPURINE26(3H7H)DIONE
3METHYL7OCTYL8(3OXOBUTAN2YLSULFANYL)PURINE26DIONE
3METHYL8((1METHYL2OXOPROPYL)SULFANYL)7OCTYL37DIHYDRO1HPURINE26DIONE
CCCCCCCCn1c(SC(C(=O)C)C)nc2c1c(=O)(nH)c(=O)n2C
CCCCCCCCN1C2=C(N=C1SC(C)C(=O)C)N(C(=O)NC2=O)C
InChI=1SC18H28N4O3Sc1567891011221415(21(4)17(25)2016(14)24)1918(22)2613(3)12(2)23h13H511H214H3(H202425)
MFCD03010245
ZINC000002315849
ZINC000002315850
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