Vitas-M small molecule compound
methyl 4-(5-{(E)-[5-oxo-1-phenyl-3-(trifluoromethyl)-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}furan-2-yl)benzoate
Catalog ID
STL508339
SMILES COC(=O)c1ccc(cc1)c1ccc(o1)/C=C\1/C(=O)N(N=C1C(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 C23H15F3N2O4 MW 440.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H15F3N2O4/c1-31-22(30)15-9-7-14(8-10-15)19-12-11-17(32-19)13-18-20(23(24,25)26)27-28(21(18)29)16-5-3-2-4-6-16/h2-13H,1H3/b18-13+InChIKey
RELBRUBTDSFJAL-QGOAFFKASA-NSynonyms
1323158
InChI=1SC23H15F3N2O4c13122(30)159714(81015)19121117(3219)131820(23(2425)26)2728(21(18)29)165324616h213H1H3b1813+
methyl4(5((~(E))(5oxo1phenyl3(trifluoromethyl)pyrazol4ylidene)methyl)furan2yl)benzoate
methyl4(5((E)(5oxo1phenyl3(trifluoromethyl)15dihydro4Hpyrazol4ylidene)methyl)furan2yl)benzoate
METHYL4(5((E)(5OXO1PHENYL3(TRIFLUOROMETHYL)PYRAZOL4YLIDENE)METHYL)FURAN2YL)BENZOATE
MFCD04083487
ZINC000032107012
ZINC32107012
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