Vitas-M small molecule compound
(4E)-5-methyl-4-[(5-methylfuran-2-yl)methylidene]-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK024945
SMILES Cc1ccc(o1)/C=C/1\C(=NN(C1=O)c1ccc(cc1)[N+](=O)[O-])C
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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 C16H13N3O4 MW 311.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13N3O4/c1-10-3-8-14(23-10)9-15-11(2)17-18(16(15)20)12-4-6-13(7-5-12)19(21)22/h3-9H,1-2H3/b15-9+InChIKey
WZGQQPFHUKBFPE-OQLLNIDSSA-NSynonyms
(4E)5METHYL4((5METHYLFURAN2YL)METHYLIDENE)2(4NITROPHENYL)24DIHYDRO3HPYRAZOL3ONE
(4E)5METHYL4((5METHYLFURAN2YL)METHYLIDENE)2(4NITROPHENYL)PYRAZOL3ONE
CC1=CC=C(O1)C=C2C(=NN(C2=O)C3=CC=C(C=C3)(N+)(=O)(O))C
Cc1ccc(o1)C=C1C(=NN(C1=O)c1ccc(cc1)(N+)(=O)(O))C
InChI=1SC16H13N3O4c1103814(2310)91511(2)1718(16(15)20)124613(7512)19(21)22h39H12H3b159+
MFCD02756049
STK024945
ZINC000004592027
ZINC04592027
ZINC4592027
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