Vitas-M small molecule compound
(4Z)-4-(5-bromo-2-hydroxy-3-methoxybenzylidene)-2-(3-chloro-4-methylphenyl)-5-hydroxy-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL509108
SMILES COc1cc(Br)cc(c1O)/C=C\1/C(=NN(C1=O)c1ccc(c(c1)Cl)C)O
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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 C18H14BrClN2O4 MW 437.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14BrClN2O4/c1-9-3-4-12(8-14(9)20)22-18(25)13(17(24)21-22)6-10-5-11(19)7-15(26-2)16(10)23/h3-8,23H,1-2H3,(H,21,24)/b13-6-InChIKey
NTOIZXBONWOFCA-MLPAPPSSSA-NSynonyms
(4~(Z))4((5bromo2hydroxy3methoxyphenyl)methylidene)1(3chloro4methylphenyl)pyrazolidine35dione
(4Z)4((5BROMO2HYDROXY3METHOXYPHENYL)METHYLIDENE)1(3CHLORO4METHYLPHENYL)PYRAZOLIDINE35DIONE
(4Z)4(5bromo2hydroxy3methoxybenzylidene)2(3chloro4methylphenyl)5hydroxy24dihydro3Hpyrazol3one
1808917
InChI=1SC18H14BrClN2O4c193412(814(9)20)2218(25)13(17(24)2122)610511(19)715(262)16(10)23h3823H12H3(H2124)b136
MFCD31657772
ZINC000032099381
ZINC32099381
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