Vitas-M small molecule compound
ethyl 4-{(4E)-4-[(2,5-dimethyl-1H-pyrrol-3-yl)methylidene]-3-hydroxy-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}benzoate
Catalog ID
STL505615
SMILES CCOC(=O)c1ccc(cc1)N1N=C(/C(=C\c2cc([nH]c2C)C)/C1=O)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 C19H19N3O4 MW 353.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O4/c1-4-26-19(25)13-5-7-15(8-6-13)22-18(24)16(17(23)21-22)10-14-9-11(2)20-12(14)3/h5-10,20H,4H2,1-3H3,(H,21,23)/b16-10+InChIKey
KBSMRKSLCGYUDF-MHWRWJLKSA-NSynonyms
50874373
ethyl4((4~(E))4((25dimethyl1~(H)pyrrol3yl)methylidene)35dioxopyrazolidin1yl)benzoate
ethyl4((4E)4((25dimethyl1Hpyrrol3yl)methylidene)3hydroxy5oxo45dihydro1Hpyrazol1yl)benzoate
MFCD31538868
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