Vitas-M small molecule compound
(2E)-3-{4-[(2,4-dibromobenzyl)oxy]-3-methoxyphenyl}-2-(morpholin-4-ylcarbonyl)prop-2-enenitrile
Catalog ID
STK183132
SMILES N#C/C(=C\c1ccc(c(c1)OC)OCc1ccc(cc1Br)Br)/C(=O)N1CCOCC1
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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 C22H20Br2N2O4 MW 536.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20Br2N2O4/c1-28-21-11-15(10-17(13-25)22(27)26-6-8-29-9-7-26)2-5-20(21)30-14-16-3-4-18(23)12-19(16)24/h2-5,10-12H,6-9,14H2,1H3/b17-10+InChIKey
LLIDPUNGWSHJPA-LICLKQGHSA-NSynonyms
(2E)3(4((24DIBROMOBENZYL)OXY)3METHOXYPHENYL)2(MORPHOLIN4YLCARBONYL)PROP2ENENITRILE
(E)3(4((24DIBROMOPHENYL)METHOXY)3METHOXYPHENYL)2(MORPHOLINE4CARBONYL)PROP2ENENITRILE
COC1=C(C=CC(=C1)C=C(C#N)C(=O)N2CCOCC2)OCC3=C(C=C(C=C3)Br)Br
InChI=1SC22H20Br2N2O4c128211115(1017(1325)22(27)2668299726)2520(21)3014163418(23)1219(16)24h251012H6914H21H3b1710+
MFCD02904896
N#CC(=Cc1ccc(c(c1)OC)OCc1ccc(cc1Br)Br)C(=O)N1CCOCC1
ZINC000001410121
ZINC1410121
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