Vitas-M small molecule compound

ethyl 3-[3,5-bis(3,4-dichlorophenyl)-4-methyl-1H-pyrazol-1-yl]propanoate

Catalog ID
STL412814
SMILES CCOC(=O)CCn1nc(c(c1c1ccc(c(c1)Cl)Cl)C)c1ccc(c(c1)Cl)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 C21H18Cl4N2O2 MW 472.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18Cl4N2O2/c1-3-29-19(28)8-9-27-21(14-5-7-16(23)18(25)11-14)12(2)20(26-27)13-4-6-15(22)17(24)10-13/h4-7,10-11H,3,8-9H2,1-2H3
InChIKey
JEVRBRYKQSMLNV-UHFFFAOYSA-N
Synonyms
1006323-96-1
1006323961
CCOC(=O)CCN1C(=C(C(=N1)C2=CC(=C(C=C2)Cl)Cl)C)C3=CC(=C(C=C3)Cl)Cl
ethyl3(35bis(34dichlorophenyl)4methyl1Hpyrazol1yl)propanoate
ethyl3(35bis(34dichlorophenyl)4methylpyrazol1yl)propanoate
InChI=1SC21H18Cl4N2O2c132919(28)892721(145716(23)18(25)1114)12(2)20(2627)134615(22)17(24)1013h471011H389H212H3
MFCD08552347
ZINC000022707974
ZINC22707974

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.