Vitas-M small molecule compound
(4E)-4-(3-bromo-4-hydroxy-5-methoxybenzylidene)-1-(3-chloro-4-fluorophenyl)pyrazolidine-3,5-dione
Catalog ID
STL431139
SMILES COc1cc(/C=C/2\C(=O)NN(C2=O)c2ccc(c(c2)Cl)F)cc(c1O)Br
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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 C17H11BrClFN2O4 MW 441.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H11BrClFN2O4/c1-26-14-6-8(5-11(18)15(14)23)4-10-16(24)21-22(17(10)25)9-2-3-13(20)12(19)7-9/h2-7,23H,1H3,(H,21,24)/b10-4+InChIKey
RLKYWCSIOPUTBW-ONNFQVAWSA-NSynonyms
(4E)4((3bromo4hydroxy5methoxyphenyl)methylidene)1(3chloro4fluorophenyl)pyrazolidine35dione
(4E)4(3bromo4hydroxy5methoxybenzylidene)1(3chloro4fluorophenyl)pyrazolidine35dione
COC1=C(C(=CC(=C1)C=C2C(=O)NN(C2=O)C3=CC(=C(C=C3)F)Cl)Br)O
COc1cc(C=C2C(=O)NN(C2=O)c2ccc(c(c2)Cl)F)cc(c1O)Br
InChI=1SC17H11BrClFN2O4c1261468(511(18)15(14)23)41016(24)2122(17(10)25)92313(20)12(19)79h2723H1H3(H2124)b104+
MFCD30711019
ZINC000033406169
ZINC33406169
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