Vitas-M small molecule compound
(5E)-5-({[(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)methyl]amino}methylidene)-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL527287
SMILES COc1c2c(CCN(C2CN/C=C/2\C(=O)NC(=O)N(C2=O)C)C)cc2c1OCO2
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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 C19H22N4O6 MW 402.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N4O6/c1-22-5-4-10-6-13-15(29-9-28-13)16(27-3)14(10)12(22)8-20-7-11-17(24)21-19(26)23(2)18(11)25/h6-7,12,20H,4-5,8-9H2,1-3H3,(H,21,24,26)/b11-7+InChIKey
XIZYIZJPUAYNGH-YRNVUSSQSA-NSynonyms
(5E)5((((4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin5yl)methyl)amino)methylidene)1methylpyrimidine246(1H3H5H)trione
(E)5((((4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin5yl)methyl)amino)methylene)1methylpyrimidine246(1H3H5H)trione
COc1c2c(CCN(C2CNC=C2C(=O)NC(=O)N(C2=O)C)C)cc2c1OCO2
InChI=1SC19H22N4O6c122541061315(2992813)16(273)14(10)12(22)82071117(24)2119(26)23(2)18(11)25h671220H4589H213H3(H212426)b117+
MFCD03267709
ZINC000020113588
ZINC000020113591
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