Vitas-M small molecule compound
3-butyl-5-(3-butyl-7-chloro-2-hydroxy-4-oxo-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-5-yl)-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-olate
Catalog ID
STL058172
SMILES CCCCn1c(O)nc2c(c1=O)C(c1c(O2)ccc(c1)Cl)c1c(=O)[nH]c(=O)n(c1[O-])CCCC
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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 C23H24ClN4O6 MW 487.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25ClN4O6/c1-3-5-9-27-20(30)16(18(29)25-22(27)32)15-13-11-12(24)7-8-14(13)34-19-17(15)21(31)28(10-6-4-2)23(33)26-19/h7-8,11,15,30H,3-6,9-10H2,1-2H3,(H,26,33)(H,25,29,32)/p-1InChIKey
BZMANHOGFYJXDB-UHFFFAOYSA-MSynonyms
3butyl5(3butyl7chloro2hydroxy4oxo35dihydro4Hchromeno(23d)pyrimidin5yl)26dioxo1236tetrahydropyrimidin4olate
CCCCn1c(O)nc2c(c1=O)C(c1c(O2)ccc(c1)Cl)c1c(=O)(nH)c(=O)n(c1(O))CCCC
ZINC000018039722
ZINC000018039724
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