Vitas-M small molecule compound
butyl 4-{[(2E)-3-(5-bromo-1-benzofuran-2-yl)prop-2-enoyl]amino}benzoate
Catalog ID
STL120240
SMILES CCCCOC(=O)c1ccc(cc1)NC(=O)/C=C/c1cc2c(o1)ccc(c2)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 C22H20BrNO4 MW 442.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20BrNO4/c1-2-3-12-27-22(26)15-4-7-18(8-5-15)24-21(25)11-9-19-14-16-13-17(23)6-10-20(16)28-19/h4-11,13-14H,2-3,12H2,1H3,(H,24,25)/b11-9+InChIKey
HDSNBBOLWUTJPG-PKNBQFBNSA-NSynonyms
butyl4(((2E)3(5bromo1benzofuran2yl)prop2enoyl)amino)benzoate
butyl4(((E)3(5bromo1benzofuran2yl)prop2enoyl)amino)benzoate
CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C=CC2=CC3=C(O2)C=CC(=C3)Br
CCCCOC(=O)c1ccc(cc1)NC(=O)C=Cc1cc2c(o1)ccc(c2)Br
InChI=1SC22H20BrNO4c123122722(26)154718(8515)2421(25)1191914161317(23)61020(16)2819h4111314H2312H21H3(H2425)b119+
MFCD20753342
ZINC000067339909
ZINC67339909
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