Vitas-M small molecule compound
ethyl 2-[(7-heptyl-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]propanoate
Catalog ID
STK001518
SMILES CCCCCCCn1c(SC(C(=O)OCC)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 C18H28N4O4S MW 396.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H28N4O4S/c1-5-7-8-9-10-11-22-13-14(21(4)17(25)20-15(13)23)19-18(22)27-12(3)16(24)26-6-2/h12H,5-11H2,1-4H3,(H,20,23,25)InChIKey
GXIWWWSSCSOFAD-UHFFFAOYSA-NSynonyms
303969-21-3CCCCCCCn1c(SC(C(=O)OCC)C)nc2c1c(=O)(nH)c(=O)n2C
CCCCCCCN1C2=C(N=C1SC(C)C(=O)OCC)N(C(=O)NC2=O)C
ethyl2((7heptyl3methyl26dioxo2367tetrahydro1Hpurin8yl)sulfanyl)propanoate
ethyl2((7heptyl3methyl26dioxo2367tetrahydro1Hpurin8yl)thio)propanoate
ETHYL2((7HEPTYL6HYDROXY3METHYL2OXO37DIHYDRO2HPURIN8YL)SULFANYL)PROPANOATE
ETHYL2(7HEPTYL3METHYL26DIOXO137TRIHYDROPURIN8YLTHIO)PROPANOATE
ETHYL2(7HEPTYL3METHYL26DIOXOPURIN8YL)SULFANYLPROPANOATE
InChI=1SC18H28N4O4Sc157891011221314(21(4)17(25)2015(13)23)1918(22)2712(3)16(24)2662h12H511H214H3(H202325)
MFCD01185930
STK001518
ZINC000008426349
ZINC000008426351
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