Vitas-M small molecule compound
(4E)-4-{3-chloro-5-methoxy-4-[(4-methylbenzyl)oxy]benzylidene}-3-methyl-1,2-oxazol-5(4H)-one
Catalog ID
STL484334
SMILES COc1cc(/C=C\2/C(=O)ON=C2C)cc(c1OCc1ccc(cc1)C)Cl
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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 C20H18ClNO4 MW 371.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClNO4/c1-12-4-6-14(7-5-12)11-25-19-17(21)9-15(10-18(19)24-3)8-16-13(2)22-26-20(16)23/h4-10H,11H2,1-3H3/b16-8+InChIKey
XKNUFBSPLXAGJJ-LZYBPNLTSA-NSynonyms
(4E)4((3chloro5methoxy4((4methylphenyl)methoxy)phenyl)methylidene)3methyl12oxazol5one
(4E)4(3chloro5methoxy4((4methylbenzyl)oxy)benzylidene)3methyl12oxazol5(4H)one
CC1=CC=C(C=C1)COC2=C(C=C(C=C2Cl)C=C3C(=NOC3=O)C)OC
COc1cc(C=C2C(=O)ON=C2C)cc(c1OCc1ccc(cc1)C)Cl
InChI=1SC20H18ClNO4c1124614(7512)11251917(21)915(1018(19)243)81613(2)222620(16)23h410H11H213H3b168+
MFCD14710542
ZINC000020033952
ZINC20033952
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