Vitas-M small molecule compound
(4E)-4-{3-bromo-5-ethoxy-4-[2-(4-methoxyphenoxy)ethoxy]benzylidene}-1-phenylpyrazolidine-3,5-dione
Catalog ID
STK019656
SMILES CCOc1cc(/C=C/2\C(=O)NN(C2=O)c2ccccc2)cc(c1OCCOc1ccc(cc1)OC)Br
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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 C27H25BrN2O6 MW 553.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25BrN2O6/c1-3-34-24-17-18(15-22-26(31)29-30(27(22)32)19-7-5-4-6-8-19)16-23(28)25(24)36-14-13-35-21-11-9-20(33-2)10-12-21/h4-12,15-17H,3,13-14H2,1-2H3,(H,29,31)/b22-15+InChIKey
QZACSTMIQJKDOA-PXLXIMEGSA-NSynonyms
(4E)4((3BROMO5ETHOXY4(2(4METHOXYPHENOXY)ETHOXY)PHENYL)METHYLIDENE)1PHENYLPYRAZOLIDINE35DIONE
(4E)4(3BROMO5ETHOXY4(2(4METHOXYPHENOXY)ETHOXY)BENZYLIDENE)1PHENYLPYRAZOLIDINE35DIONE
CCOC1=C(C(=CC(=C1)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)Br)OCCOC4=CC=C(C=C4)OC
CCOc1cc(C=C2C(=O)NN(C2=O)c2ccccc2)cc(c1OCCOc1ccc(cc1)OC)Br
InChI=1SC27H25BrN2O6c1334241718(152226(31)2930(27(22)32)197546819)1623(28)25(24)361413352111920(332)101221h4121517H31314H212H3(H2931)b2215+
MFCD05975626
STK019656
ZINC000097958012
ZINC97958012
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