Vitas-M small molecule compound
1-[5-ethyl-3-hydroxy-3-(trifluoromethyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]-2-(2-methylphenoxy)ethanone
Catalog ID
STK097995
SMILES CCC1CCC2=NN(C(C2C1)(O)C(F)(F)F)C(=O)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 C19H23F3N2O3 MW 384.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23F3N2O3/c1-3-13-8-9-15-14(10-13)18(26,19(20,21)22)24(23-15)17(25)11-27-16-7-5-4-6-12(16)2/h4-7,13-14,26H,3,8-11H2,1-2H3InChIKey
PYHQHGLUPUOWLY-UHFFFAOYSA-NSynonyms
1(5ethyl3hydroxy3(trifluoromethyl)33a4567hexahydro2Hindazol2yl)2(2methylphenoxy)ethanone
1(5ethyl3hydroxy3(trifluoromethyl)4567tetrahydro3aHindazol2yl)2(2methylphenoxy)ethanone
CCC1CCC2=NN(C(C2C1)(C(F)(F)F)O)C(=O)COC3=CC=CC=C3C
CCC1CCC2=NN(C(C2C1)(O)C(F)(F)F)C(=O)COc1ccccc1C
InChI=1SC19H23F3N2O3c1313891514(1013)18(2619(2021)22)24(2315)17(25)112716754612(16)2h47131426H3811H212H3
MFCD08679428
STK097995
ZINC000004677135
ZINC000239174401
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