Vitas-M small molecule compound

3-[(4Z)-4-{[5-(3,5-dichlorophenyl)furan-2-yl]methylidene}-5-oxo-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]benzoic acid

Catalog ID
STK536889
SMILES Clc1cc(Cl)cc(c1)c1ccc(o1)/C=C/1\C(=O)N(N=C1C(F)(F)F)c1cccc(c1)C(=O)O

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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 C22H11Cl2F3N2O4 MW 495.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H11Cl2F3N2O4/c23-13-6-12(7-14(24)9-13)18-5-4-16(33-18)10-17-19(22(25,26)27)28-29(20(17)30)15-3-1-2-11(8-15)21(31)32/h1-10H,(H,31,32)/b17-10-
InChIKey
FFTWFEQWIQNYIK-YVLHZVERSA-N
Synonyms

(Z)3(4((5(35dichlorophenyl)furan2yl)methylene)5oxo3(trifluoromethyl)45dihydro1Hpyrazol1yl)benzoicacid
3((4Z)4((5(35dichlorophenyl)furan2yl)methylidene)5oxo3(trifluoromethyl)45dihydro1Hpyrazol1yl)benzoicacid
3((4Z)4((5(35DICHLOROPHENYL)FURAN2YL)METHYLIDENE)5OXO3(TRIFLUOROMETHYL)PYRAZOL1YL)BENZOICACID
C1=CC(=CC(=C1)N2C(=O)C(=CC3=CC=C(O3)C4=CC(=CC(=C4)Cl)Cl)C(=N2)C(F)(F)F)C(=O)O
Clc1cc(Cl)cc(c1)c1ccc(o1)C=C1C(=O)N(N=C1C(F)(F)F)c1cccc(c1)C(=O)O
InChI=1SC22H11Cl2F3N2O4c2313612(714(24)913)185416(3318)101719(22(2526)27)2829(20(17)30)1531211(815)21(31)32h110H(H3132)b1710
MFCD02326519
ZINC000009334795
ZINC9334795

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Available files

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