Vitas-M small molecule compound
(2E)-3-{2-bromo-4-[(2,4-dichlorobenzyl)oxy]-5-methoxyphenyl}-2-cyano-N-(4-ethoxyphenyl)prop-2-enamide
Catalog ID
STK387601
SMILES CCOc1ccc(cc1)NC(=O)/C(=C/c1cc(OC)c(cc1Br)OCc1ccc(cc1Cl)Cl)/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 C26H21BrCl2N2O4 MW 576.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21BrCl2N2O4/c1-3-34-21-8-6-20(7-9-21)31-26(32)18(14-30)10-17-11-24(33-2)25(13-22(17)27)35-15-16-4-5-19(28)12-23(16)29/h4-13H,3,15H2,1-2H3,(H,31,32)/b18-10+InChIKey
WNQOUSVJVAIRBG-VCHYOVAHSA-NSynonyms
(2E)3(2BROMO4((24DICHLOROBENZYL)OXY)5METHOXYPHENYL)2CYANON(4ETHOXYPHENYL)PROP2ENAMIDE
(2E)3(4((24DICHLOROPHENYL)METHOXY)2BROMO5METHOXYPHENYL)2CYANON(4ETHOXYPHENYL)PROP2ENAMIDE
(E)3(2BROMO4((24DICHLOROPHENYL)METHOXY)5METHOXYPHENYL)2CYANON(4ETHOXYPHENYL)PROP2ENAMIDE
CCOC1=CC=C(C=C1)NC(=O)C(=CC2=CC(=C(C=C2Br)OCC3=C(C=C(C=C3)Cl)Cl)OC)C#N
CCOc1ccc(cc1)NC(=O)C(=Cc1cc(OC)c(cc1Br)OCc1ccc(cc1Cl)Cl)C#N
InChI=1SC26H21BrCl2N2O4c1334218620(7921)3126(32)18(1430)10171124(332)25(1322(17)27)3515164519(28)1223(16)29h413H315H212H3(H3132)b1810+
MFCD02067022
ZINC000004196254
ZINC4196254
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