Vitas-M small molecule compound
ethyl 2-{[(2E)-2-cyano-3-{5-[4-(ethoxycarbonyl)phenyl]furan-2-yl}prop-2-enoyl]amino}benzoate
Catalog ID
STL016680
SMILES CCOC(=O)c1ccc(cc1)c1ccc(o1)/C=C(/C(=O)Nc1ccccc1C(=O)OCC)\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 C26H22N2O6 MW 458.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22N2O6/c1-3-32-25(30)18-11-9-17(10-12-18)23-14-13-20(34-23)15-19(16-27)24(29)28-22-8-6-5-7-21(22)26(31)33-4-2/h5-15H,3-4H2,1-2H3,(H,28,29)/b19-15+InChIKey
HUWGDGFOXASFSQ-XDJHFCHBSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=C(C#N)C(=O)NC3=CC=CC=C3C(=O)OCC
CCOC(=O)c1ccc(cc1)c1ccc(o1)C=C(C(=O)Nc1ccccc1C(=O)OCC)C#N
ethyl2(((2E)2cyano3(5(4(ethoxycarbonyl)phenyl)furan2yl)prop2enoyl)amino)benzoate
ETHYL2(((E)2CYANO3(5(4ETHOXYCARBONYLPHENYL)FURAN2YL)PROP2ENOYL)AMINO)BENZOATE
ETHYL2((2E)2CYANO3(5(4(ETHOXYCARBONYL)PHENYL)(2FURYL))PROP2ENOYLAMINO)BENZOATE
InChI=1SC26H22N2O6c133225(30)1811917(101218)23141320(3423)1519(1627)24(29)2822865721(22)26(31)3342h515H34H212H3(H2829)b1915+
MFCD02957005
ZINC000001453965
ZINC01453965
ZINC1453965
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