Vitas-M small molecule compound
(5E)-1-tert-butyl-5-{[2-(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)hydrazinyl]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL327913
SMILES O=C1NC(=O)N(C(=O)/C/1=C/NNc1nc2c(n1C)c(=O)n(c(=O)n2C)C)C(C)(C)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 C17H22N8O5 MW 418.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N8O5/c1-17(2,3)25-12(27)8(11(26)20-15(25)29)7-18-21-14-19-10-9(22(14)4)13(28)24(6)16(30)23(10)5/h7,18H,1-6H3,(H,19,21)(H,20,26,29)/b8-7+InChIKey
LEUWNYFNFCQSPG-BQYQJAHWSA-NSynonyms
(5E)1tertbutyl5((2(137trimethyl26dioxo2367tetrahydro1Hpurin8yl)hydrazinyl)methylidene)pyrimidine246(1H3H5H)trione
(5E)1tertbutyl5((2(137trimethyl26dioxopurin8yl)hydrazinyl)methylidene)13diazinane246trione
(E)1(tertbutyl)5((2(137trimethyl26dioxo2367tetrahydro1Hpurin8yl)hydrazinyl)methylene)pyrimidine246(1H3H5H)trione
CC(C)(C)N1C(=O)C(=CNNC2=NC3=C(N2C)C(=O)N(C(=O)N3C)C)C(=O)NC1=O
InChI=1SC17H22N8O5c117(23)2512(27)8(11(26)2015(25)29)718211419109(22(14)4)13(28)24(6)16(30)23(10)5h718H16H3(H1921)(H202629)b87+
MFCD01955259
O=C1NC(=O)N(C(=O)C1=CNNc1nc2c(n1C)c(=O)n(c(=O)n2C)C)C(C)(C)C
ZINC000009327445
ZINC09327445
ZINC9327445
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