Vitas-M small molecule compound
(4E)-2-(4-nitrophenyl)-5-phenyl-4-[4-(prop-2-en-1-yloxy)benzylidene]-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK732199
SMILES C=CCOc1ccc(cc1)/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 C25H19N3O4 MW 425.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19N3O4/c1-2-16-32-22-14-8-18(9-15-22)17-23-24(19-6-4-3-5-7-19)26-27(25(23)29)20-10-12-21(13-11-20)28(30)31/h2-15,17H,1,16H2/b23-17+InChIKey
ZHHSUZKYBCETDJ-HAVVHWLPSA-NSynonyms
(4E)2(4nitrophenyl)5phenyl4((4prop2enoxyphenyl)methylidene)pyrazol3one
(4E)2(4nitrophenyl)5phenyl4(4(prop2en1yloxy)benzylidene)24dihydro3Hpyrazol3one
C=CCOC1=CC=C(C=C1)C=C2C(=NN(C2=O)C3=CC=C(C=C3)(N+)(=O)(O))C4=CC=CC=C4
C=CCOc1ccc(cc1)C=C1C(=NN(C1=O)c1ccc(cc1)(N+)(=O)(O))c1ccccc1
InChI=1SC25H19N3O4c1216322214818(91522)172324(196435719)2627(25(23)29)20101221(131120)28(30)31h21517H116H2b2317+
MFCD02307544
ZINC000036092159
ZINC36092159
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