Vitas-M small molecule compound
(4E)-4-({5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl}methylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK387768
SMILES CC1=NN(C(=O)/C/1=C/c1ccc(o1)c1ccc(c(c1)C(F)(F)F)Cl)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 C22H14ClF3N2O2 MW 430.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H14ClF3N2O2/c1-13-17(21(29)28(27-13)15-5-3-2-4-6-15)12-16-8-10-20(30-16)14-7-9-19(23)18(11-14)22(24,25)26/h2-12H,1H3/b17-12+InChIKey
XOCMUVCNFGHPTC-SFQUDFHCSA-NSynonyms
(4E)4((5(4CHLORO3(TRIFLUOROMETHYL)PHENYL)FURAN2YL)METHYLIDENE)5METHYL2PHENYL24DIHYDRO3HPYRAZOL3ONE
(4E)4((5(4CHLORO3(TRIFLUOROMETHYL)PHENYL)FURAN2YL)METHYLIDENE)5METHYL2PHENYLPYRAZOL3ONE
4((5(4CHLORO3(TRIFLUOROMETHYL)PHENYL)(2FURYL))METHYLENE)3METHYL1PHENYL12DIAZOLIN5ONE
CC1=NN(C(=O)C1=Cc1ccc(o1)c1ccc(c(c1)C(F)(F)F)Cl)c1ccccc1
CC1=NN(C(=O)C1=CC2=CC=C(O2)C3=CC(=C(C=C3)Cl)C(F)(F)F)C4=CC=CC=C4
InChI=1SC22H14ClF3N2O2c11317(21(29)28(2713)155324615)121681020(3016)147919(23)18(1114)22(2425)26h212H1H3b1712+
MFCD03032046
ZINC000100148057
ZINC100148057
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