Vitas-M small molecule compound
(2Z)-3-{3-bromo-4-[(4-iodobenzyl)oxy]phenyl}-2-cyano-N-(4-ethoxyphenyl)prop-2-enamide
Catalog ID
STK182379
SMILES CCOc1ccc(cc1)NC(=O)/C(=C\c1ccc(c(c1)Br)OCc1ccc(cc1)I)/C#N
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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 C25H20BrIN2O3 MW 603.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20BrIN2O3/c1-2-31-22-10-8-21(9-11-22)29-25(30)19(15-28)13-18-5-12-24(23(26)14-18)32-16-17-3-6-20(27)7-4-17/h3-14H,2,16H2,1H3,(H,29,30)/b19-13-InChIKey
YRNYFIBEDJBPPS-UYRXBGFRSA-NSynonyms
(2Z)3(3BROMO4((4IODOBENZYL)OXY)PHENYL)2CYANON(4ETHOXYPHENYL)PROP2ENAMIDE
(Z)3(3bromo4((4iodophenyl)methoxy)phenyl)2cyanoN(4ethoxyphenyl)prop2enamide
CCOC1=CC=C(C=C1)NC(=O)C(=CC2=CC(=C(C=C2)OCC3=CC=C(C=C3)I)Br)C#N
CCOc1ccc(cc1)NC(=O)C(=Cc1ccc(c(c1)Br)OCc1ccc(cc1)I)C#N
InChI=1SC25H20BrIN2O3c12312210821(91122)2925(30)19(1528)131851224(23(26)1418)3216173620(27)7417h314H216H21H3(H2930)b1913
MFCD02195118
ZINC000097960707
ZINC97960707
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