Vitas-M small molecule compound
methyl 4-[({2-[3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-1H-pyrrol-1-yl}acetyl)amino]benzoate
Catalog ID
STL075057
SMILES COC(=O)c1ccc(cc1)NC(=O)Cn1cccc1c1onc(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 C23H18N4O6 MW 446.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18N4O6/c1-30-23(29)14-4-7-16(8-5-14)24-20(28)12-27-10-2-3-17(27)22-25-21(26-33-22)15-6-9-18-19(11-15)32-13-31-18/h2-11H,12-13H2,1H3,(H,24,28)InChIKey
JLHJYEGTXJIGMG-UHFFFAOYSA-NSynonyms
COC(=O)C1=CC=C(C=C1)NC(=O)CN2C=CC=C2C3=NC(=NO3)C4=CC5=C(C=C4)OCO5
InChI=1SC23H18N4O6c13023(29)144716(8514)2420(28)1227102317(27)222521(263322)15691819(1115)32133118h211H1213H21H3(H2428)
methyl4(((2(3(13benzodioxol5yl)124oxadiazol5yl)1Hpyrrol1yl)acetyl)amino)benzoate
methyl4((2(2(3(13benzodioxol5yl)124oxadiazol5yl)pyrrol1yl)acetyl)amino)benzoate
MFCD18196417
ZINC000057487045
ZINC57487045
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