Vitas-M small molecule compound
(4E)-2-(3-chlorophenyl)-4-{[5-(4-fluorophenyl)furan-2-yl]methylidene}-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK740139
SMILES Fc1ccc(cc1)c1ccc(o1)/C=C/1\C(=NN(C1=O)c1cccc(c1)Cl)C
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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 C21H14ClFN2O2 MW 380.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14ClFN2O2/c1-13-19(21(26)25(24-13)17-4-2-3-15(22)11-17)12-18-9-10-20(27-18)14-5-7-16(23)8-6-14/h2-12H,1H3/b19-12+InChIKey
KFIAGZKQQLLMLN-XDHOZWIPSA-NSynonyms
(4E)2(3chlorophenyl)4((5(4fluorophenyl)furan2yl)methylidene)5methyl24dihydro3Hpyrazol3one
(4E)2(3CHLOROPHENYL)4((5(4FLUOROPHENYL)FURAN2YL)METHYLIDENE)5METHYLPYRAZOL3ONE
CC1=NN(C(=O)C1=CC2=CC=C(O2)C3=CC=C(C=C3)F)C4=CC(=CC=C4)Cl
Fc1ccc(cc1)c1ccc(o1)C=C1C(=NN(C1=O)c1cccc(c1)Cl)C
InChI=1SC21H14ClFN2O2c11319(21(26)25(2413)1742315(22)1117)121891020(2718)145716(23)8614h212H1H3b1912+
MFCD01871004
ZINC000100085740
ZINC100085740
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