Vitas-M small molecule compound
(2E)-3-[4-(benzyloxy)-3-bromo-5-methoxyphenyl]-2-cyano-N-(3-ethoxyphenyl)prop-2-enamide
Catalog ID
STK329768
SMILES CCOc1cccc(c1)NC(=O)/C(=C/c1cc(Br)c(c(c1)OC)OCc1ccccc1)/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 C26H23BrN2O4 MW 507.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23BrN2O4/c1-3-32-22-11-7-10-21(15-22)29-26(30)20(16-28)12-19-13-23(27)25(24(14-19)31-2)33-17-18-8-5-4-6-9-18/h4-15H,3,17H2,1-2H3,(H,29,30)/b20-12+InChIKey
VCBSWEZQPXJQSX-UDWIEESQSA-NSynonyms
(2E)3(4(benzyloxy)3bromo5methoxyphenyl)2cyanoN(3ethoxyphenyl)prop2enamide
(E)3(3bromo5methoxy4phenylmethoxyphenyl)2cyanoN(3ethoxyphenyl)prop2enamide
CCOC1=CC=CC(=C1)NC(=O)C(=CC2=CC(=C(C(=C2)Br)OCC3=CC=CC=C3)OC)C#N
CCOc1cccc(c1)NC(=O)C(=Cc1cc(Br)c(c(c1)OC)OCc1ccccc1)C#N
InChI=1SC26H23BrN2O4c1332221171021(1522)2926(30)20(1628)12191323(27)25(24(1419)312)3317188546918h415H317H212H3(H2930)b2012+
MFCD09962046
ZINC000018192445
ZINC18192445
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