Vitas-M small molecule compound
methyl [(7-hexyl-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]acetate
Catalog ID
STK840894
SMILES CCCCCCn1c(SCC(=O)OC)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 C15H22N4O4S MW 354.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H22N4O4S/c1-4-5-6-7-8-19-11-12(18(2)14(22)17-13(11)21)16-15(19)24-9-10(20)23-3/h4-9H2,1-3H3,(H,17,21,22)InChIKey
PGESGLMKPJFZIR-UHFFFAOYSA-NSynonyms
500273-39-22((7HEXYL26DIKETO3METHYLPURIN8YL)THIO)ACETICACIDMETHYLESTER
2((7HEXYL3METHYL26DIOXO8PURINYL)THIO)ACETICACIDMETHYLESTER
500273392
CCCCCCn1c(SCC(=O)OC)nc2c1c(=O)(nH)c(=O)n2C
CCCCCCN1C2=C(N=C1SCC(=O)OC)N(C(=O)NC2=O)C
InChI=1SC15H22N4O4Sc145678191112(18(2)14(22)1713(11)21)1615(19)24910(20)233h49H213H3(H172122)
methyl((7hexyl3methyl26dioxo2367tetrahydro1Hpurin8yl)sulfanyl)acetate
methyl2((7hexyl3methyl26dioxo2367tetrahydro1Hpurin8yl)thio)acetate
METHYL2(7HEXYL3METHYL26BIS(OXIDANYLIDENE)PURIN8YL)SULFANYLETHANOATE
METHYL2(7HEXYL3METHYL26DIOXO137TRIHYDROPURIN8YLTHIO)ACETATE
METHYL2(7HEXYL3METHYL26DIOXOPURIN8YL)SULFANYLACETATE
MFCD03302954
ZINC000002352976
ZINC02352976
ZINC2352976
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