Vitas-M small molecule compound
(4E)-4-(2-methoxybenzylidene)-2-(4-nitrophenyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL426824
SMILES COc1ccccc1/C=C/1\C(=NN(C1=O)c1ccc(cc1)[N+](=O)[O-])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 C23H17N3O4 MW 399.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17N3O4/c1-30-21-10-6-5-9-17(21)15-20-22(16-7-3-2-4-8-16)24-25(23(20)27)18-11-13-19(14-12-18)26(28)29/h2-15H,1H3/b20-15+InChIKey
ODAPVPZGHLNHAX-HMMYKYKNSA-NSynonyms
(4E)4((2methoxyphenyl)methylidene)2(4nitrophenyl)5phenylpyrazol3one
(4E)4(2methoxybenzylidene)2(4nitrophenyl)5phenyl24dihydro3Hpyrazol3one
COC1=CC=CC=C1C=C2C(=NN(C2=O)C3=CC=C(C=C3)(N+)(=O)(O))C4=CC=CC=C4
COc1ccccc1C=C1C(=NN(C1=O)c1ccc(cc1)(N+)(=O)(O))c1ccccc1
InChI=1SC23H17N3O4c130211065917(21)152022(167324816)2425(23(20)27)18111319(141218)26(28)29h215H1H3b2015+
MFCD30710424
ZINC000083318962
ZINC83318962
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