Vitas-M small molecule compound
ethyl 5-{1-(1,3-benzodioxol-5-yl)-3-[(3,4-dichlorobenzyl)amino]-3-oxopropyl}-4-hydroxy-6-oxo-1,6-dihydropyridine-3-carboxylate
Catalog ID
STL435167
SMILES CCOC(=O)c1c[nH]c(=O)c(c1O)C(c1ccc2c(c1)OCO2)CC(=O)NCc1ccc(c(c1)Cl)Cl
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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 C25H22Cl2N2O7 MW 533.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22Cl2N2O7/c1-2-34-25(33)16-11-29-24(32)22(23(16)31)15(14-4-6-19-20(8-14)36-12-35-19)9-21(30)28-10-13-3-5-17(26)18(27)7-13/h3-8,11,15H,2,9-10,12H2,1H3,(H,28,30)(H2,29,31,32)InChIKey
LUWWENKCJPUWFB-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CNC(=O)C(=C1O)C(CC(=O)NCC2=CC(=C(C=C2)Cl)Cl)C3=CC4=C(C=C3)OCO4
CCOC(=O)c1c(nH)c(=O)c(c1O)C(c1ccc2c(c1)OCO2)CC(=O)NCc1ccc(c(c1)Cl)Cl
ethyl5(1(13benzodioxol5yl)3((34dichlorobenzyl)amino)3oxopropyl)4hydroxy6oxo16dihydropyridine3carboxylate
ethyl5(1(13benzodioxol5yl)3((34dichlorophenyl)methylamino)3oxopropyl)4hydroxy6oxo1Hpyridine3carboxylate
InChI=1SC25H22Cl2N2O7c123425(33)16112924(32)22(23(16)31)15(14461920(814)36123519)921(30)2810133517(26)18(27)713h381115H291012H21H3(H2830)(H2293132)
MFCD30711703
ZINC000253496538
ZINC000253496539
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