Vitas-M small molecule compound
(4Z)-4-{4-[(2,6-dichlorobenzyl)oxy]-3-ethoxybenzylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK385698
SMILES CCOc1cc(ccc1OCc1c(Cl)cccc1Cl)/C=C\1/C(=NN(C1=O)c1ccccc1)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 C26H22Cl2N2O3 MW 481.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22Cl2N2O3/c1-3-32-25-15-18(12-13-24(25)33-16-21-22(27)10-7-11-23(21)28)14-20-17(2)29-30(26(20)31)19-8-5-4-6-9-19/h4-15H,3,16H2,1-2H3/b20-14-InChIKey
ZDHUTBJUXORCPW-ZHZULCJRSA-NSynonyms
(4Z)4((4((26dichlorophenyl)methoxy)3ethoxyphenyl)methylidene)5methyl2phenylpyrazol3one
(4Z)4(4((26DICHLOROBENZYL)OXY)3ETHOXYBENZYLIDENE)5METHYL2PHENYL24DIHYDRO3HPYRAZOL3ONE
CCOC1=C(C=CC(=C1)C=C2C(=NN(C2=O)C3=CC=CC=C3)C)OCC4=C(C=CC=C4Cl)Cl
CCOc1cc(ccc1OCc1c(Cl)cccc1Cl)C=C1C(=NN(C1=O)c1ccccc1)C
InChI=1SC26H22Cl2N2O3c1332251518(121324(25)33162122(27)1071123(21)28)142017(2)2930(26(20)31)198546919h415H316H212H3b2014
MFCD06194880
ZINC000023402426
ZINC23402426
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