Vitas-M small molecule compound
2-{2-[3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-1H-pyrrol-1-yl}-1-(4-methylpiperidin-1-yl)ethanone
Catalog ID
STL075084
SMILES CC1CCN(CC1)C(=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 C21H22N4O4 MW 394.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O4/c1-14-6-9-24(10-7-14)19(26)12-25-8-2-3-16(25)21-22-20(23-29-21)15-4-5-17-18(11-15)28-13-27-17/h2-5,8,11,14H,6-7,9-10,12-13H2,1H3InChIKey
HEJVFXIUWVKRIY-UHFFFAOYSA-NSynonyms
2(2(3(13benzodioxol5yl)124oxadiazol5yl)1Hpyrrol1yl)1(4methylpiperidin1yl)ethanone
2(2(3(13benzodioxol5yl)124oxadiazol5yl)pyrrol1yl)1(4methylpiperidin1yl)ethanone
CC1CCN(CC1)C(=O)CN2C=CC=C2C3=NC(=NO3)C4=CC5=C(C=C4)OCO5
InChI=1SC21H22N4O4c1146924(10714)19(26)122582316(25)212220(232921)15451718(1115)28132717h2581114H679101213H21H3
MFCD18196444
ZINC000057487072
ZINC57487072
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