Vitas-M small molecule compound
2-{2-[3-(3-bromo-4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-1H-pyrrol-1-yl}-N-(3-methylbenzyl)acetamide
Catalog ID
STL074903
SMILES O=C(Cn1cccc1c1onc(n1)c1ccc(c(c1)Br)F)NCc1cccc(c1)C
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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 C22H18BrFN4O2 MW 469.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18BrFN4O2/c1-14-4-2-5-15(10-14)12-25-20(29)13-28-9-3-6-19(28)22-26-21(27-30-22)16-7-8-18(24)17(23)11-16/h2-11H,12-13H2,1H3,(H,25,29)InChIKey
YVAFJLKNVXAWRR-UHFFFAOYSA-NSynonyms
2(2(3(3bromo4fluorophenyl)124oxadiazol5yl)1Hpyrrol1yl)N(3methylbenzyl)acetamide
2(2(3(3bromo4fluorophenyl)124oxadiazol5yl)pyrrol1yl)N((3methylphenyl)methyl)acetamide
CC1=CC(=CC=C1)CNC(=O)CN2C=CC=C2C3=NC(=NO3)C4=CC(=C(C=C4)F)Br
InChI=1SC22H18BrFN4O2c11442515(1014)122520(29)132893619(28)222621(273022)167818(24)17(23)1116h211H1213H21H3(H2529)
MFCD18196263
ZINC000067207774
ZINC67207774
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