Vitas-M small molecule compound

2-{[3-(4-methoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-N,N'-bis[3-(trifluoromethyl)phenyl]propanediamide

Catalog ID
STK811483
SMILES COc1ccc(cc1C)c1nn(cc1/C=C(/C(=O)Nc1cccc(c1)C(F)(F)F)\C(=O)Nc1cccc(c1)C(F)(F)F)c1ccccc1

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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 C35H26F6N4O3 MW 664.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H26F6N4O3/c1-21-16-22(14-15-30(21)48-2)31-23(20-45(44-31)28-12-4-3-5-13-28)17-29(32(46)42-26-10-6-8-24(18-26)34(36,37)38)33(47)43-27-11-7-9-25(19-27)35(39,40)41/h3-20H,1-2H3,(H,42,46)(H,43,47)
InChIKey
MHTZRYZRZVODEA-UHFFFAOYSA-N
Synonyms

2((3(4methoxy3methylphenyl)1phenyl1Hpyrazol4yl)methylidene)NNbis(3(trifluoromethyl)phenyl)propanediamide
2((3(4METHOXY3METHYLPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)NNBIS(3(TRIFLUOROMETHYL)PHENYL)PROPANEDIAMIDE
CC1=C(C=CC(=C1)C2=NN(C=C2C=C(C(=O)NC3=CC=CC(=C3)C(F)(F)F)C(=O)NC4=CC=CC(=C4)C(F)(F)F)C5=CC=CC=C5)OC
COc1ccc(cc1C)c1nn(cc1C=C(C(=O)Nc1cccc(c1)C(F)(F)F)C(=O)Nc1cccc(c1)C(F)(F)F)c1ccccc1
InChI=1SC35H26F6N4O3c1211622(141530(21)482)3123(2045(4431)28124351328)1729(32(46)4226106824(1826)34(3637)38)33(47)4327117925(1927)35(3940)41h320H12H3(H4246)(H4347)
MFCD06264869
ZINC000098046323
ZINC98046323

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.