Vitas-M small molecule compound
(4E)-4-{3-bromo-4-[2-(2-chlorophenoxy)ethoxy]-5-methoxybenzylidene}-1-phenylpyrazolidine-3,5-dione
Catalog ID
STK078988
SMILES COc1cc(cc(c1OCCOc1ccccc1Cl)Br)/C=C/1\C(=O)NN(C1=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 C25H20BrClN2O5 MW 543.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20BrClN2O5/c1-32-22-15-16(13-18-24(30)28-29(25(18)31)17-7-3-2-4-8-17)14-19(26)23(22)34-12-11-33-21-10-6-5-9-20(21)27/h2-10,13-15H,11-12H2,1H3,(H,28,30)/b18-13+InChIKey
ZZIZBUWEPGEKKX-QGOAFFKASA-NSynonyms
(4E)4((3BROMO4(2(2CHLOROPHENOXY)ETHOXY)5METHOXYPHENYL)METHYLIDENE)1PHENYLPYRAZOLIDINE35DIONE
(4E)4(3BROMO4(2(2CHLOROPHENOXY)ETHOXY)5METHOXYBENZYLIDENE)1PHENYLPYRAZOLIDINE35DIONE
COC1=C(C(=CC(=C1)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)Br)OCCOC4=CC=CC=C4Cl
COc1cc(cc(c1OCCOc1ccccc1Cl)Br)C=C1C(=O)NN(C1=O)c1ccccc1
InChI=1SC25H20BrClN2O5c132221516(131824(30)2829(25(18)31)177324817)1419(26)23(22)34121133211065920(21)27h2101315H1112H21H3(H2830)b1813+
MFCD05975625
STK078988
ZINC000097959053
ZINC97959053
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