Vitas-M small molecule compound
methyl {[1,3-dimethyl-2,6-dioxo-7-(3-phenylpropyl)-2,3,6,7-tetrahydro-1H-purin-8-yl]sulfanyl}acetate
Catalog ID
STK840856
SMILES COC(=O)CSc1nc2c(n1CCCc1ccccc1)c(=O)n(c(=O)n2C)C
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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 C19H22N4O4S MW 402.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N4O4S/c1-21-16-15(17(25)22(2)19(21)26)23(18(20-16)28-12-14(24)27-3)11-7-10-13-8-5-4-6-9-13/h4-6,8-9H,7,10-12H2,1-3H3InChIKey
ZYPLSTNHBYPYBA-UHFFFAOYSA-NSynonyms
384373-83-5384373835
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)SCC(=O)OC)CCCC3=CC=CC=C3
InChI=1SC19H22N4O4Sc1211615(17(25)22(2)19(21)26)23(18(2016)281214(24)273)11710138546913h4689H71012H213H3
methyl((13dimethyl26dioxo7(3phenylpropyl)2367tetrahydro1Hpurin8yl)sulfanyl)acetate
methyl2((13dimethyl26dioxo7(3phenylpropyl)2367tetrahydro1Hpurin8yl)thio)acetate
METHYL2(13DIMETHYL26DIOXO7(3PHENYLPROPYL)137TRIHYDROPURIN8YLTHIO)ACETATE
METHYL2(13DIMETHYL26DIOXO7(3PHENYLPROPYL)PURIN8YL)SULFANYLACETATE
MFCD03284931
ZINC000000637929
ZINC00637929
ZINC637929
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