Vitas-M small molecule compound
2-{2-[3-(3-bromo-4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-1H-pyrrol-1-yl}-1-(3,4-dihydroisoquinolin-2(1H)-yl)ethanone
Catalog ID
STL091866
SMILES O=C(N1CCc2c(C1)cccc2)Cn1cccc1c1onc(n1)c1ccc(c(c1)Br)F
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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 C23H18BrFN4O2 MW 481.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18BrFN4O2/c24-18-12-16(7-8-19(18)25)22-26-23(31-27-22)20-6-3-10-28(20)14-21(30)29-11-9-15-4-1-2-5-17(15)13-29/h1-8,10,12H,9,11,13-14H2InChIKey
HJCCYDUOKOSIIO-UHFFFAOYSA-NSynonyms
2(2(3(3bromo4fluorophenyl)124oxadiazol5yl)1Hpyrrol1yl)1(34dihydroisoquinolin2(1H)yl)ethanone
2(2(3(3bromo4fluorophenyl)124oxadiazol5yl)pyrrol1yl)1(34dihydro1Hisoquinolin2yl)ethanone
C1CN(CC2=CC=CC=C21)C(=O)CN3C=CC=C3C4=NC(=NO4)C5=CC(=C(C=C5)F)Br
InChI=1SC23H18BrFN4O2c24181216(7819(18)25)222623(312722)20631028(20)1421(30)2911915412517(15)1329h181012H9111314H2
MFCD18786262
ZINC000067207723
ZINC67207723
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