Vitas-M small molecule compound
2-ethoxy-4-[(Z)-(3-hydroxy-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenyl 3,4-dichlorobenzoate
Catalog ID
STK134693
SMILES CCOc1cc(ccc1OC(=O)c1ccc(c(c1)Cl)Cl)/C=C\1/C(=NN(C1=O)c1ccccc1)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 C25H18Cl2N2O5 MW 497.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18Cl2N2O5/c1-2-33-22-13-15(8-11-21(22)34-25(32)16-9-10-19(26)20(27)14-16)12-18-23(30)28-29(24(18)31)17-6-4-3-5-7-17/h3-14H,2H2,1H3,(H,28,30)/b18-12-InChIKey
HLFHSYJAXJWWQG-PDGQHHTCSA-NSynonyms
(4((Z)(35dioxo1phenylpyrazolidin4ylidene)methyl)2ethoxyphenyl)34dichlorobenzoate
2ETHOXY4((Z)(3HYDROXY5OXO1PHENYL15DIHYDRO4HPYRAZOL4YLIDENE)METHYL)PHENYL34DICHLOROBENZOATE
4((Z)(35DIOXO1PHENYLPYRAZOLIDIN4YLIDENE)METHYL)2ETHOXYPHENYL34DICHLOROBENZOATE
CCOC1=C(C=CC(=C1)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)OC(=O)C4=CC(=C(C=C4)Cl)Cl
CCOc1cc(ccc1OC(=O)c1ccc(c(c1)Cl)Cl)C=C1C(=NN(C1=O)c1ccccc1)O
InChI=1SC25H18Cl2N2O5c1233221315(81121(22)3425(32)1691019(26)20(27)1416)121823(30)2829(24(18)31)176435717h314H2H21H3(H2830)b1812
MFCD04542719
ZINC000018181381
ZINC18181381
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