Vitas-M small molecule compound
(4Z)-4-({5-hydroxy-3-methyl-1-[3-(trifluoromethyl)phenyl]-1H-pyrazol-4-yl}methylidene)-5-methyl-2-[3-(trifluoromethyl)phenyl]-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL507463
SMILES CC1=NN(C(=O)/C/1=C\c1c(C)nn(c1O)c1cccc(c1)C(F)(F)F)c1cccc(c1)C(F)(F)F
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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 C23H16F6N4O2 MW 494.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16F6N4O2/c1-12-18(20(34)32(30-12)16-7-3-5-14(9-16)22(24,25)26)11-19-13(2)31-33(21(19)35)17-8-4-6-15(10-17)23(27,28)29/h3-11,34H,1-2H3/b19-11-InChIKey
NPINALXDLKQUAM-ODLFYWEKSA-NSynonyms
(4Z)4((5hydroxy3methyl1(3(trifluoromethyl)phenyl)1Hpyrazol4yl)methylidene)5methyl2(3(trifluoromethyl)phenyl)24dihydro3Hpyrazol3one
InChI=1SC23H16F6N4O2c11218(20(34)32(3012)1673514(916)22(2425)26)111913(2)3133(21(19)35)1784615(1017)23(2728)29h31134H12H3b1911
MFCD31615146
ZINC001505840668
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