Vitas-M small molecule compound
ethyl [(7-dodecyl-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]acetate
Catalog ID
STK700286
SMILES CCCCCCCCCCCCn1c(SCC(=O)OCC)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 C22H36N4O4S MW 452.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H36N4O4S/c1-4-6-7-8-9-10-11-12-13-14-15-26-18-19(25(3)21(29)24-20(18)28)23-22(26)31-16-17(27)30-5-2/h4-16H2,1-3H3,(H,24,28,29)InChIKey
ZKOFPPOHZKGCPI-UHFFFAOYSA-NSynonyms
327167-49-7327167497
CCCCCCCCCCCCn1c(SCC(=O)OCC)nc2c1c(=O)(nH)c(=O)n2C
CCCCCCCCCCCCN1C2=C(N=C1SCC(=O)OCC)N(C(=O)NC2=O)C
ethyl((7dodecyl3methyl26dioxo2367tetrahydro1Hpurin8yl)sulfanyl)acetate
ethyl2((7dodecyl3methyl26dioxo2367tetrahydro1Hpurin8yl)thio)acetate
ETHYL2(7DODECYL3METHYL26DIOXOPURIN8YL)SULFANYLACETATE
InChI=1SC22H36N4O4Sc146789101112131415261819(25(3)21(29)2420(18)28)2322(26)311617(27)3052h416H213H3(H242829)
MFCD01143543
ZINC000097949575
ZINC97949575
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