Vitas-M small molecule compound
ethyl 5-[1-(1,3-benzodioxol-5-yl)-3-{[2-(1H-imidazol-4-yl)ethyl]amino}-3-oxopropyl]-4-hydroxy-6-oxo-1,6-dihydropyridine-3-carboxylate
Catalog ID
STL435202
SMILES CCOC(=O)c1c[nH]c(=O)c(c1O)C(c1ccc2c(c1)OCO2)CC(=O)NCCc1c[nH]cn1
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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 C23H24N4O7 MW 468.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N4O7/c1-2-32-23(31)16-10-26-22(30)20(21(16)29)15(13-3-4-17-18(7-13)34-12-33-17)8-19(28)25-6-5-14-9-24-11-27-14/h3-4,7,9-11,15H,2,5-6,8,12H2,1H3,(H,24,27)(H,25,28)(H2,26,29,30)InChIKey
MJBACCJQHPATSX-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CNC(=O)C(=C1O)C(CC(=O)NCCC2=CN=CN2)C3=CC4=C(C=C3)OCO4
CCOC(=O)c1c(nH)c(=O)c(c1O)C(c1ccc2c(c1)OCO2)CC(=O)NCCc1c(nH)cn1
ethyl5(1(13benzodioxol5yl)3((2(1Himidazol4yl)ethyl)amino)3oxopropyl)4hydroxy6oxo16dihydropyridine3carboxylate
ethyl5(1(13benzodioxol5yl)3(2(1Himidazol5yl)ethylamino)3oxopropyl)4hydroxy6oxo1Hpyridine3carboxylate
InChI=1SC23H24N4O7c123223(31)16102622(30)20(21(16)29)15(13341718(713)34123317)819(28)256514924112714h34791115H256812H21H3(H2427)(H2528)(H2262930)
MFCD30711738
ZINC000253496544
ZINC000253496545
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