Vitas-M small molecule compound
(2E)-3-(4-ethoxy-3-methoxyphenyl)-1-(5-fluoro-3-methyl-1-benzofuran-2-yl)prop-2-en-1-one
Catalog ID
STK903518
SMILES CCOc1ccc(cc1OC)/C=C/C(=O)c1oc2c(c1C)cc(cc2)F
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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 C21H19FO4 MW 354.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19FO4/c1-4-25-19-9-6-14(11-20(19)24-3)5-8-17(23)21-13(2)16-12-15(22)7-10-18(16)26-21/h5-12H,4H2,1-3H3/b8-5+InChIKey
IKIZVNRWFCGMSP-VMPITWQZSA-NSynonyms
(2E)3(4ethoxy3methoxyphenyl)1(5fluoro3methyl1benzofuran2yl)prop2en1one
(E)3(4ETHOXY3METHOXYPHENYL)1(5FLUORO3METHYL1BENZOFURAN2YL)PROP2EN1ONE
CCOC1=C(C=C(C=C1)C=CC(=O)C2=C(C3=C(O2)C=CC(=C3)F)C)OC
CCOc1ccc(cc1OC)C=CC(=O)c1oc2c(c1C)cc(cc2)F
InChI=1SC21H19FO4c1425199614(1120(19)243)5817(23)2113(2)161215(22)71018(16)2621h512H4H213H3b85+
MFCD03510596
ZINC000004276464
ZINC04276464
ZINC4276464
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