Vitas-M small molecule compound
propyl 3-{[(2E)-3-(5-bromo-1-benzofuran-2-yl)prop-2-enoyl]amino}benzoate
Catalog ID
STL120059
SMILES CCCOC(=O)c1cccc(c1)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 C21H18BrNO4 MW 428.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18BrNO4/c1-2-10-26-21(25)14-4-3-5-17(12-14)23-20(24)9-7-18-13-15-11-16(22)6-8-19(15)27-18/h3-9,11-13H,2,10H2,1H3,(H,23,24)/b9-7+InChIKey
WBMWUXZWRORBBU-VQHVLOKHSA-NSynonyms
CCCOC(=O)C1=CC(=CC=C1)NC(=O)C=CC2=CC3=C(O2)C=CC(=C3)Br
CCCOC(=O)c1cccc(c1)NC(=O)C=Cc1cc2c(o1)ccc(c2)Br
InChI=1SC21H18BrNO4c12102621(25)1443517(1214)2320(24)971813151116(22)6819(15)2718h391113H210H21H3(H2324)b97+
MFCD20753161
propyl3(((2E)3(5bromo1benzofuran2yl)prop2enoyl)amino)benzoate
propyl3(((E)3(5bromo1benzofuran2yl)prop2enoyl)amino)benzoate
ZINC000067339344
ZINC67339344
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