Vitas-M small molecule compound
1-[3-hydroxy-3-(trifluoromethyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]-2-(2-methylphenoxy)ethanone
Catalog ID
STK191521
SMILES O=C(N1N=C2C(C1(O)C(F)(F)F)CCCC2)COc1ccccc1C
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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 C17H19F3N2O3 MW 356.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19F3N2O3/c1-11-6-2-5-9-14(11)25-10-15(23)22-16(24,17(18,19)20)12-7-3-4-8-13(12)21-22/h2,5-6,9,12,24H,3-4,7-8,10H2,1H3InChIKey
DZLXUPTUZYTPLD-UHFFFAOYSA-NSynonyms
1(3hydroxy3(trifluoromethyl)33a4567hexahydro2Hindazol2yl)2(2methylphenoxy)ethanone
1(3hydroxy3(trifluoromethyl)4567tetrahydro3aHindazol2yl)2(2methylphenoxy)ethanone
CC1=CC=CC=C1OCC(=O)N2C(C3CCCCC3=N2)(C(F)(F)F)O
InChI=1SC17H19F3N2O3c111625914(11)251015(23)2216(2417(1819)20)12734813(12)2122h25691224H347810H21H3
MFCD02226228
ZINC000000871725
ZINC000000871728
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