Vitas-M small molecule compound
8-(2-{(Z)-[1-(furan-2-ylmethyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}hydrazinyl)-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STL037453
SMILES O=C1N=C(O)/C(=C/NNc2nc3c(n2C)c(=O)n(c(=O)n3C)C)/C(=O)N1Cc1ccco1
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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 C18H18N8O6 MW 442.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N8O6/c1-23-11-12(24(2)18(31)25(3)15(11)29)20-16(23)22-19-7-10-13(27)21-17(30)26(14(10)28)8-9-5-4-6-32-9/h4-7,19H,8H2,1-3H3,(H,20,22)(H,21,27,30)/b10-7-InChIKey
JMUILCLCISUVSR-YFHOEESVSA-NSynonyms
(5Z)1(furan2ylmethyl)5((2(137trimethyl26dioxopurin8yl)hydrazinyl)methylidene)13diazinane246trione
8(2((Z)(1(furan2ylmethyl)4hydroxy26dioxo16dihydropyrimidin5(2H)ylidene)methyl)hydrazinyl)137trimethyl37dihydro1Hpurine26dione
CN1C2=C(N=C1NNC=C3C(=O)NC(=O)N(C3=O)CC4=CC=CO4)N(C(=O)N(C2=O)C)C
InChI=1SC18H18N8O6c1231112(24(2)18(31)25(3)15(11)29)2016(23)221971013(27)2117(30)26(14(10)28)89546329h4719H8H213H3(H2022)(H212730)b107
MFCD04078266
O=C1N=C(O)C(=CNNc2nc3c(n2C)c(=O)n(c(=O)n3C)C)C(=O)N1Cc1ccco1
ZINC000009312885
ZINC9312885
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