Vitas-M small molecule compound
2-(3,4-dimethylphenoxy)-1-[3-hydroxy-3-(trifluoromethyl)-3a,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-2(3H)-yl]ethanone
Catalog ID
STK983808
SMILES O=C(N1N=C2C(C1(O)C(F)(F)F)CCCCC2)COc1ccc(c(c1)C)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 C19H23F3N2O3 MW 384.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23F3N2O3/c1-12-8-9-14(10-13(12)2)27-11-17(25)24-18(26,19(20,21)22)15-6-4-3-5-7-16(15)23-24/h8-10,15,26H,3-7,11H2,1-2H3InChIKey
AXQKTTYQSLEIPV-UHFFFAOYSA-NSynonyms
384357-12-42(34dimethylphenoxy)1(3hydroxy3(trifluoromethyl)3a45678hexahydrocyclohepta(c)pyrazol2(3H)yl)ethanone
2(34dimethylphenoxy)1(3hydroxy3(trifluoromethyl)3a45678hexahydrocyclohepta(c)pyrazol2yl)ethanone
384357124
CC1=C(C=C(C=C1)OCC(=O)N2C(C3CCCCCC3=N2)(C(F)(F)F)O)C
InChI=1SC19H23F3N2O3c1128914(1013(12)2)271117(25)2418(2619(2021)22)156435716(15)2324h8101526H3711H212H3
MFCD02766265
ZINC000005024389
ZINC000005024392
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