Vitas-M small molecule compound
(4E)-4-{2-[2-(3,4-dimethylphenoxy)ethoxy]-5-methoxybenzylidene}-1-phenylpyrazolidine-3,5-dione
Catalog ID
STK062555
SMILES COc1ccc(c(c1)/C=C/1\C(=O)NN(C1=O)c1ccccc1)OCCOc1ccc(c(c1)C)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 C27H26N2O5 MW 458.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2O5/c1-18-9-10-23(15-19(18)2)33-13-14-34-25-12-11-22(32-3)16-20(25)17-24-26(30)28-29(27(24)31)21-7-5-4-6-8-21/h4-12,15-17H,13-14H2,1-3H3,(H,28,30)/b24-17+InChIKey
JXUUKQHKZFQOHY-JJIBRWJFSA-NSynonyms
(4E)4((2(2(34DIMETHYLPHENOXY)ETHOXY)5METHOXYPHENYL)METHYLIDENE)1PHENYLPYRAZOLIDINE35DIONE
(4E)4(2(2(34DIMETHYLPHENOXY)ETHOXY)5METHOXYBENZYLIDENE)1PHENYLPYRAZOLIDINE35DIONE
CC1=C(C=C(C=C1)OCCOC2=C(C=C(C=C2)OC)C=C3C(=O)NN(C3=O)C4=CC=CC=C4)C
COc1ccc(c(c1)C=C1C(=O)NN(C1=O)c1ccccc1)OCCOc1ccc(c(c1)C)C
InChI=1SC27H26N2O5c11891023(1519(18)2)3313143425121122(323)1620(25)172426(30)2829(27(24)31)217546821h4121517H1314H213H3(H2830)b2417+
MFCD05975638
STK062555
ZINC000013897107
ZINC13897107
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