Vitas-M small molecule compound
(4Z)-2-(4-chlorophenyl)-4-{[5-(4-chlorophenyl)furan-2-yl]methylidene}-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK077563
SMILES Clc1ccc(cc1)c1ccc(o1)/C=C/1\C(=O)N(N=C1C(F)(F)F)c1ccc(cc1)Cl
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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 C21H11Cl2F3N2O2 MW 451.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H11Cl2F3N2O2/c22-13-3-1-12(2-4-13)18-10-9-16(30-18)11-17-19(21(24,25)26)27-28(20(17)29)15-7-5-14(23)6-8-15/h1-11H/b17-11-InChIKey
VFXBDTUFVDJTPL-BOPFTXTBSA-NSynonyms
(4Z)2(4CHLOROPHENYL)4((5(4CHLOROPHENYL)FURAN2YL)METHYLIDENE)5(TRIFLUOROMETHYL)24DIHYDRO3HPYRAZOL3ONE
(4Z)2(4CHLOROPHENYL)4((5(4CHLOROPHENYL)FURAN2YL)METHYLIDENE)5(TRIFLUOROMETHYL)PYRAZOL3ONE
C1=CC(=CC=C1C2=CC=C(O2)C=C3C(=NN(C3=O)C4=CC=C(C=C4)Cl)C(F)(F)F)Cl
Clc1ccc(cc1)c1ccc(o1)C=C1C(=O)N(N=C1C(F)(F)F)c1ccc(cc1)Cl
InChI=1SC21H11Cl2F3N2O2c22133112(2413)1810916(3018)111719(21(2425)26)2728(20(17)29)157514(23)6815h111Hb1711
MFCD02909428
STK077563
ZINC000013899525
ZINC13899525
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