Vitas-M small molecule compound
{5-[(2-chloro-6-methylphenoxy)methyl]furan-2-yl}[5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]methanone
Catalog ID
STK311963
SMILES O=C(N1N=CCC1(O)C(F)(F)F)c1ccc(o1)COc1c(C)cccc1Cl
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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 C17H14ClF3N2O4 MW 402.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14ClF3N2O4/c1-10-3-2-4-12(18)14(10)26-9-11-5-6-13(27-11)15(24)23-16(25,7-8-22-23)17(19,20)21/h2-6,8,25H,7,9H2,1H3InChIKey
ZGJKXOIBVPCSJO-UHFFFAOYSA-NSynonyms
832729-04-1(5((2chloro6methylphenoxy)methyl)furan2yl)(5hydroxy5(trifluoromethyl)45dihydro1Hpyrazol1yl)methanone
(5((2chloro6methylphenoxy)methyl)furan2yl)(5hydroxy5(trifluoromethyl)4Hpyrazol1yl)methanone
832729041
CC1=C(C(=CC=C1)Cl)OCC2=CC=C(O2)C(=O)N3C(CC=N3)(C(F)(F)F)O
InChI=1SC17H14ClF3N2O4c11032412(18)14(10)269115613(2711)15(24)2316(25782223)17(1920)21h26825H79H21H3
MFCD04140489
ZINC000006924892
ZINC000006924904
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