Vitas-M small molecule compound
3-[(4Z)-4-({5-[3-(methoxycarbonyl)phenyl]furan-2-yl}methylidene)-5-oxo-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]benzoic acid
Catalog ID
STL407124
SMILES COC(=O)c1cccc(c1)c1ccc(o1)/C=C/1\C(=O)N(N=C1C(F)(F)F)c1cccc(c1)C(=O)O
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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 C24H15F3N2O6 MW 484.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H15F3N2O6/c1-34-23(33)15-6-2-4-13(10-15)19-9-8-17(35-19)12-18-20(24(25,26)27)28-29(21(18)30)16-7-3-5-14(11-16)22(31)32/h2-12H,1H3,(H,31,32)/b18-12-InChIKey
RYXKZJIRTNQUKS-PDGQHHTCSA-NSynonyms
3((4Z)4((5(3(methoxycarbonyl)phenyl)furan2yl)methylidene)5oxo3(trifluoromethyl)45dihydro1Hpyrazol1yl)benzoicacid
3((4Z)4((5(3METHOXYCARBONYLPHENYL)FURAN2YL)METHYLIDENE)5OXO3(TRIFLUOROMETHYL)PYRAZOL1YL)BENZOICACID
3(4((5(3(METHOXYCARBONYL)PHENYL)2FURYL)METHYLENE)5OXO3(TRIFLUOROMETHYL)45DIHYDRO1HPYRAZOL1YL)BENZOICACID
COC(=O)C1=CC=CC(=C1)C2=CC=C(O2)C=C3C(=NN(C3=O)C4=CC=CC(=C4)C(=O)O)C(F)(F)F
COC(=O)c1cccc(c1)c1ccc(o1)C=C1C(=O)N(N=C1C(F)(F)F)c1cccc(c1)C(=O)O
InChI=1SC24H15F3N2O6c13423(33)1562413(1015)199817(3519)121820(24(2526)27)2829(21(18)30)1673514(1116)22(31)32h212H1H3(H3132)b1812
MFCD01788021
ZINC000002125649
ZINC2125649
Check stock
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Check stock on Vitas-MAvailable files
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