Vitas-M small molecule compound
4-{(Z)-[1-(3-chloro-4-methylphenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl}-2-ethoxyphenyl acetate
Catalog ID
STL431850
SMILES CCOc1cc(ccc1OC(=O)C)/C=C\1/C(=O)NN(C1=O)c1ccc(c(c1)Cl)C
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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 C21H19ClN2O5 MW 414.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClN2O5/c1-4-28-19-10-14(6-8-18(19)29-13(3)25)9-16-20(26)23-24(21(16)27)15-7-5-12(2)17(22)11-15/h5-11H,4H2,1-3H3,(H,23,26)/b16-9-InChIKey
RLHWGECDSHZPPG-SXGWCWSVSA-NSynonyms
(4((Z)(1(3CHLORO4METHYLPHENYL)35DIOXOPYRAZOLIDIN4YLIDENE)METHYL)2ETHOXYPHENYL)ACETATE
4((Z)(1(3chloro4methylphenyl)35dioxopyrazolidin4ylidene)methyl)2ethoxyphenylacetate
CCOC1=C(C=CC(=C1)C=C2C(=O)NN(C2=O)C3=CC(=C(C=C3)C)Cl)OC(=O)C
CCOc1cc(ccc1OC(=O)C)C=C1C(=O)NN(C1=O)c1ccc(c(c1)Cl)C
InChI=1SC21H19ClN2O5c1428191014(6818(19)2913(3)25)91620(26)2324(21(16)27)157512(2)17(22)1115h511H4H213H3(H2326)b169
MFCD01158394
ZINC000000832866
ZINC00832866
ZINC832866
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