Vitas-M small molecule compound

(4E)-4-{5-chloro-2-[2-(4-chloro-3-methylphenoxy)ethoxy]benzylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one

Catalog ID
STK000228
SMILES Clc1ccc(c(c1)/C=C/1\C(=NN(C1=O)c1ccccc1)C)OCCOc1ccc(c(c1)C)Cl

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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/c1-17-14-22(9-10-24(17)28)32-12-13-33-25-11-8-20(27)15-19(25)16-23-18(2)29-30(26(23)31)21-6-4-3-5-7-21/h3-11,14-16H,12-13H2,1-2H3/b23-16+
InChIKey
UMDKERJBGQSOLS-XQNSMLJCSA-N
Synonyms

(4E)4((5CHLORO2(2(4CHLORO3METHYLPHENOXY)ETHOXY)PHENYL)METHYLIDENE)5METHYL2PHENYLPYRAZOL3ONE
(4E)4(5CHLORO2(2(4CHLORO3METHYLPHENOXY)ETHOXY)BENZYLIDENE)5METHYL2PHENYL24DIHYDRO3HPYRAZOL3ONE
CC1=C(C=CC(=C1)OCCOC2=C(C=C(C=C2)Cl)C=C3C(=NN(C3=O)C4=CC=CC=C4)C)Cl
Clc1ccc(c(c1)C=C1C(=NN(C1=O)c1ccccc1)C)OCCOc1ccc(c(c1)C)Cl
InChI=1SC26H22Cl2N2O3c1171422(91024(17)28)321213332511820(27)1519(25)162318(2)2930(26(23)31)216435721h3111416H1213H212H3b2316+
MFCD03033543
STK000228
ZINC000008915897
ZINC08915897
ZINC8915897

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Available files

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