Vitas-M small molecule compound
(4Z)-4-(3-bromo-5-methoxy-4-{2-[2-(prop-2-en-1-yl)phenoxy]ethoxy}benzylidene)-1-phenylpyrazolidine-3,5-dione
Catalog ID
STK063446
SMILES C=CCc1ccccc1OCCOc1c(Br)cc(cc1OC)/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 C28H25BrN2O5 MW 549.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25BrN2O5/c1-3-9-20-10-7-8-13-24(20)35-14-15-36-26-23(29)17-19(18-25(26)34-2)16-22-27(32)30-31(28(22)33)21-11-5-4-6-12-21/h3-8,10-13,16-18H,1,9,14-15H2,2H3,(H,30,32)/b22-16-InChIKey
PVFWNDCJWMGJRH-JWGURIENSA-NSynonyms
(4Z)4((3bromo5methoxy4(2(2prop2enylphenoxy)ethoxy)phenyl)methylidene)1phenylpyrazolidine35dione
(4Z)4(3BROMO5METHOXY4(2(2(PROP2EN1YL)PHENOXY)ETHOXY)BENZYLIDENE)1PHENYLPYRAZOLIDINE35DIONE
C=CCc1ccccc1OCCOc1c(Br)cc(cc1OC)C=C1C(=O)NN(C1=O)c1ccccc1
COC1=C(C(=CC(=C1)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)Br)OCCOC4=CC=CC=C4CC=C
InChI=1SC28H25BrN2O5c1392010781324(20)351415362623(29)1719(1825(26)342)162227(32)3031(28(22)33)21115461221h3810131618H191415H22H3(H3032)b2216
MFCD03183798
STK063446
ZINC000097966210
ZINC97966210
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