Vitas-M small molecule compound
(4Z)-4-{[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene}-5-hydroxy-2-[3-(trifluoromethyl)phenyl]-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL508989
SMILES OC1=NN(C(=O)/C/1=C\c1ccc(o1)c1cc(ccc1Cl)[N+](=O)[O-])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 C21H11ClF3N3O5 MW 477.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H11ClF3N3O5/c22-17-6-4-13(28(31)32)9-15(17)18-7-5-14(33-18)10-16-19(29)26-27(20(16)30)12-3-1-2-11(8-12)21(23,24)25/h1-10H,(H,26,29)/b16-10-InChIKey
SXSHLCDGENRXEA-YBEGLDIGSA-NSynonyms
(4~(Z))4((5(2chloro5nitrophenyl)furan2yl)methylidene)1(3(trifluoromethyl)phenyl)pyrazolidine35dione
(4Z)4((5(2CHLORO5NITROPHENYL)FURAN2YL)METHYLIDENE)1(3(TRIFLUOROMETHYL)PHENYL)PYRAZOLIDINE35DIONE
(4Z)4((5(2chloro5nitrophenyl)furan2yl)methylidene)5hydroxy2(3(trifluoromethyl)phenyl)24dihydro3Hpyrazol3one
6269394
InChI=1SC21H11ClF3N3O5c22176413(28(31)32)915(17)187514(3318)101619(29)2627(20(16)30)1231211(812)21(2324)25h110H(H2629)b1610
MFCD31657639
ZINC000015938947
ZINC15938947
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