Vitas-M small molecule compound
ethyl 4-(5-{(E)-[2-(morpholin-4-yl)-4-oxo-1,3-thiazol-5(4H)-ylidene]methyl}furan-2-yl)benzoate
Catalog ID
STK822564
SMILES CCOC(=O)c1ccc(cc1)c1ccc(o1)/C=C\1/SC(=NC1=O)N1CCOCC1
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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 C21H20N2O5S MW 412.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O5S/c1-2-27-20(25)15-5-3-14(4-6-15)17-8-7-16(28-17)13-18-19(24)22-21(29-18)23-9-11-26-12-10-23/h3-8,13H,2,9-12H2,1H3/b18-13+InChIKey
QLIKSBHKYCULNF-QGOAFFKASA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=C3C(=O)N=C(S3)N4CCOCC4
CCOC(=O)c1ccc(cc1)c1ccc(o1)C=C1SC(=NC1=O)N1CCOCC1
ethyl4(5((E)(2(morpholin4yl)4oxo13thiazol5(4H)ylidene)methyl)furan2yl)benzoate
ETHYL4(5((E)(2MORPHOLIN4YL4OXO13THIAZOL5YLIDENE)METHYL)FURAN2YL)BENZOATE
InChI=1SC21H20N2O5Sc122720(25)155314(4615)178716(2817)131819(24)2221(2918)2391126121023h3813H2912H21H3b1813+
MFCD03212161
ZINC000005871406
ZINC05871406
ZINC5871406
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