Vitas-M small molecule compound
ethyl 4-(5-{(E)-2-cyano-2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]ethenyl}furan-2-yl)benzoate
Catalog ID
STL017176
SMILES CCOC(=O)c1ccc(cc1)c1ccc(o1)/C=C(/c1scc(n1)c1ccc(cc1)F)\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 C25H17FN2O3S MW 444.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17FN2O3S/c1-2-30-25(29)18-5-3-17(4-6-18)23-12-11-21(31-23)13-19(14-27)24-28-22(15-32-24)16-7-9-20(26)10-8-16/h3-13,15H,2H2,1H3/b19-13+InChIKey
GZUOCHSCSVKLJO-CPNJWEJPSA-NSynonyms
(E)ETHYL4(5(2CYANO2(4(4FLUOROPHENYL)THIAZOL2YL)VINYL)FURAN2YL)BENZOATE
CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=C(C#N)C3=NC(=CS3)C4=CC=C(C=C4)F
CCOC(=O)c1ccc(cc1)c1ccc(o1)C=C(c1scc(n1)c1ccc(cc1)F)C#N
ETHYL4(5((1E)2CYANO2(4(4FLUOROPHENYL)(13THIAZOL2YL))VINYL)2FURYL)BENZOATE
ethyl4(5((E)2cyano2(4(4fluorophenyl)13thiazol2yl)ethenyl)furan2yl)benzoate
InChI=1SC25H17FN2O3Sc123025(29)185317(4618)23121121(3123)1319(1427)242822(153224)167920(26)10816h31315H2H21H3b1913+
MFCD04066515
ZINC000009489387
ZINC09489387
ZINC9489387
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