Vitas-M small molecule compound
(2E)-3-[2-bromo-5-ethoxy-4-(prop-2-yn-1-yloxy)phenyl]-2-[(4-phenylpiperazin-1-yl)carbonyl]prop-2-enenitrile
Catalog ID
STK183604
SMILES CCOc1cc(/C=C(/C(=O)N2CCN(CC2)c2ccccc2)\C#N)c(cc1OCC#C)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 C25H24BrN3O3 MW 494.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24BrN3O3/c1-3-14-32-24-17-22(26)19(16-23(24)31-4-2)15-20(18-27)25(30)29-12-10-28(11-13-29)21-8-6-5-7-9-21/h1,5-9,15-17H,4,10-14H2,2H3/b20-15+InChIKey
DVSOTTOHXMSDQJ-HMMYKYKNSA-NSynonyms
(2E)3(2BROMO5ETHOXY4(PROP2YN1YLOXY)PHENYL)2((4PHENYLPIPERAZIN1YL)CARBONYL)PROP2ENENITRILE
(E)3(2BROMO5ETHOXY4PROP2YNOXYPHENYL)2(4PHENYLPIPERAZINE1CARBONYL)PROP2ENENITRILE
CCOC1=C(C=C(C(=C1)C=C(C#N)C(=O)N2CCN(CC2)C3=CC=CC=C3)Br)OCC#C
CCOc1cc(C=C(C(=O)N2CCN(CC2)c2ccccc2)C#N)c(cc1OCC#C)Br
InChI=1SC25H24BrN3O3c131432241722(26)19(1623(24)3142)1520(1827)25(30)29121028(111329)218657921h1591517H41014H22H3b2015+
MFCD02795757
ZINC000009262418
ZINC09262418
ZINC9262418
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