Vitas-M small molecule compound
(4E)-4-{2-[2-(4-bromophenoxy)ethoxy]-5-nitrobenzylidene}-1-phenylpyrazolidine-3,5-dione
Catalog ID
STK018281
SMILES Brc1ccc(cc1)OCCOc1ccc(cc1/C=C/1\C(=O)NN(C1=O)c1ccccc1)[N+](=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 C24H18BrN3O6 MW 524.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18BrN3O6/c25-17-6-9-20(10-7-17)33-12-13-34-22-11-8-19(28(31)32)14-16(22)15-21-23(29)26-27(24(21)30)18-4-2-1-3-5-18/h1-11,14-15H,12-13H2,(H,26,29)/b21-15+InChIKey
YQOJKTFMYNMUKF-RCCKNPSSSA-NSynonyms
(4E)4((2(2(4BROMOPHENOXY)ETHOXY)5NITROPHENYL)METHYLIDENE)1PHENYLPYRAZOLIDINE35DIONE
(4E)4(2(2(4BROMOPHENOXY)ETHOXY)5NITROBENZYLIDENE)1PHENYLPYRAZOLIDINE35DIONE
Brc1ccc(cc1)OCCOc1ccc(cc1C=C1C(=O)NN(C1=O)c1ccccc1)(N+)(=O)(O)
C1=CC=C(C=C1)N2C(=O)C(=CC3=C(C=CC(=C3)(N+)(=O)(O))OCCOC4=CC=C(C=C4)Br)C(=O)N2
InChI=1SC24H18BrN3O6c25176920(10717)331213342211819(28(31)32)1416(22)152123(29)2627(24(21)30)184213518h1111415H1213H2(H2629)b2115+
MFCD02122186
STK018281
ZINC000100272914
ZINC100272914
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