Vitas-M small molecule compound
2-{2-[3-(3-bromo-4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-1H-pyrrol-1-yl}-1-(2-ethylpiperidin-1-yl)ethanone
Catalog ID
STL074891
SMILES CCC1CCCCN1C(=O)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 C21H22BrFN4O2 MW 461.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22BrFN4O2/c1-2-15-6-3-4-11-27(15)19(28)13-26-10-5-7-18(26)21-24-20(25-29-21)14-8-9-17(23)16(22)12-14/h5,7-10,12,15H,2-4,6,11,13H2,1H3InChIKey
XTTOVQZRQMGEQW-UHFFFAOYSA-NSynonyms
2(2(3(3bromo4fluorophenyl)124oxadiazol5yl)1Hpyrrol1yl)1(2ethylpiperidin1yl)ethanone
2(2(3(3bromo4fluorophenyl)124oxadiazol5yl)pyrrol1yl)1(2ethylpiperidin1yl)ethanone
CCC1CCCCN1C(=O)CN2C=CC=C2C3=NC(=NO3)C4=CC(=C(C=C4)F)Br
InChI=1SC21H22BrFN4O2c12156341127(15)19(28)1326105718(26)212420(252921)148917(23)16(22)1214h57101215H2461113H21H3
MFCD18196251
ZINC000057486925
ZINC000057486926
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