Vitas-M small molecule compound
(4Z)-5-hydroxy-2-(4-methylphenyl)-4-{[5-(3-nitrophenyl)furan-2-yl]methylidene}-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL443427
SMILES Cc1ccc(cc1)N1N=C(/C(=C/c2ccc(o2)c2cccc(c2)[N+](=O)[O-])/C1=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 C21H15N3O5 MW 389.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15N3O5/c1-13-5-7-15(8-6-13)23-21(26)18(20(25)22-23)12-17-9-10-19(29-17)14-3-2-4-16(11-14)24(27)28/h2-12H,1H3,(H,22,25)/b18-12-InChIKey
FFAONVWNCQONAF-PDGQHHTCSA-NSynonyms
(4Z)1(4METHYLPHENYL)4((5(3NITROPHENYL)FURAN2YL)METHYLIDENE)PYRAZOLIDINE35DIONE
(4Z)5hydroxy2(4methylphenyl)4((5(3nitrophenyl)furan2yl)methylidene)24dihydro3Hpyrazol3one
Cc1ccc(cc1)N1N=C(C(=Cc2ccc(o2)c2cccc(c2)(N+)(=O)(O))C1=O)O
InChI=1SC21H15N3O5c1135715(8613)2321(26)18(20(25)2223)121791019(2917)1432416(1114)24(27)28h212H1H3(H2225)b1812
MFCD30712622
ZINC000005010286
ZINC05010286
ZINC5010286
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