Vitas-M small molecule compound
[3-hydroxy-3-(trifluoromethyl)-3a,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-2(3H)-yl](3-methylphenyl)methanone
Catalog ID
STK794734
SMILES Cc1cccc(c1)C(=O)N1N=C2C(C1(O)C(F)(F)F)CCCCC2
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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 C17H19F3N2O2 MW 340.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19F3N2O2/c1-11-6-5-7-12(10-11)15(23)22-16(24,17(18,19)20)13-8-3-2-4-9-14(13)21-22/h5-7,10,13,24H,2-4,8-9H2,1H3InChIKey
MXYFQCPBKRXFOP-UHFFFAOYSA-NSynonyms
(3hydroxy3(trifluoromethyl)3a45678hexahydrocyclohepta(c)pyrazol2(3H)yl)(3methylphenyl)methanone
(3hydroxy3(trifluoromethyl)3a45678hexahydrocyclohepta(c)pyrazol2yl)(3methylphenyl)methanone
CC1=CC=CC(=C1)C(=O)N2C(C3CCCCCC3=N2)(C(F)(F)F)O
InChI=1SC17H19F3N2O2c11165712(1011)15(23)2216(2417(1819)20)138324914(13)2122h57101324H2489H21H3
MFCD01821711
ZINC000000079271
ZINC000004524740
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