Vitas-M small molecule compound
(4E)-4-{[5-(2-chloro-4-nitrophenyl)furan-2-yl]methylidene}-2-phenyl-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL506258
SMILES O=C1N(N=C(/C/1=C\c1ccc(o1)c1ccc(cc1Cl)[N+](=O)[O-])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 C21H11ClF3N3O4 MW 461.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H11ClF3N3O4/c22-17-10-13(28(30)31)6-8-15(17)18-9-7-14(32-18)11-16-19(21(23,24)25)26-27(20(16)29)12-4-2-1-3-5-12/h1-11H/b16-11+InChIKey
XVNPXCAGMSODNS-LFIBNONCSA-NSynonyms
(4~(E))4((5(2chloro4nitrophenyl)furan2yl)methylidene)2phenyl5(trifluoromethyl)pyrazol3one
(4E)4((5(2chloro4nitrophenyl)furan2yl)methylidene)2phenyl5(trifluoromethyl)24dihydro3Hpyrazol3one
(4E)4((5(2CHLORO4NITROPHENYL)FURAN2YL)METHYLIDENE)2PHENYL5(TRIFLUOROMETHYL)PYRAZOL3ONE
2292413
InChI=1SC21H11ClF3N3O4c22171013(28(30)31)6815(17)189714(3218)111619(21(2324)25)2627(20(16)29)124213512h111Hb1611+
MFCD04083495
ZINC000001153469
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