Vitas-M small molecule compound
methyl 2-[({3-[3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-6-oxo-5,6-dihydropyridazin-1(4H)-yl}acetyl)amino]benzoate
Catalog ID
STL144755
SMILES COC(=O)c1ccccc1NC(=O)CN1N=C(CCC1=O)c1onc(n1)c1ccc2c(c1)OCO2
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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 C23H19N5O7 MW 477.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N5O7/c1-32-23(31)14-4-2-3-5-15(14)24-19(29)11-28-20(30)9-7-16(26-28)22-25-21(27-35-22)13-6-8-17-18(10-13)34-12-33-17/h2-6,8,10H,7,9,11-12H2,1H3,(H,24,29)InChIKey
LLVQLPPNJXFIOU-UHFFFAOYSA-NSynonyms
COC(=O)C1=CC=CC=C1NC(=O)CN2C(=O)CCC(=N2)C3=NC(=NO3)C4=CC5=C(C=C4)OCO5
InChI=1SC23H19N5O7c13223(31)14423515(14)2419(29)112820(30)9716(2628)222521(273522)13681718(1013)34123317h26810H791112H21H3(H2429)
methyl2(((3(3(13benzodioxol5yl)124oxadiazol5yl)6oxo56dihydropyridazin1(4H)yl)acetyl)amino)benzoate
methyl2((2(3(3(13benzodioxol5yl)124oxadiazol5yl)6oxo45dihydropyridazin1yl)acetyl)amino)benzoate
MFCD20752348
ZINC000071328411
ZINC71328411
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