Vitas-M small molecule compound

(4Z)-2-(2,5-dichlorophenyl)-4-(4-methoxybenzylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one

Catalog ID
STK396391
SMILES COc1ccc(cc1)/C=C\1/C(=NN(C1=O)c1cc(Cl)ccc1Cl)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 C18H14Cl2N2O2 MW 361.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14Cl2N2O2/c1-11-15(9-12-3-6-14(24-2)7-4-12)18(23)22(21-11)17-10-13(19)5-8-16(17)20/h3-10H,1-2H3/b15-9-
InChIKey
TTZUFNVPHWXLHE-DHDCSXOGSA-N
Synonyms
329689-72-7
(4Z)2(25DICHLOROPHENYL)4((4METHOXYPHENYL)METHYLIDENE)5METHYLPYRAZOL3ONE
(4Z)2(25DICHLOROPHENYL)4(4METHOXYBENZYLIDENE)5METHYL24DIHYDRO3HPYRAZOL3ONE
(Z)1(25dichlorophenyl)4(4methoxybenzylidene)3methyl1Hpyrazol5(4H)one
1(25DICHLOROPHENYL)4((4METHOXYPHENYL)METHYLENE)3METHYL12DIAZOLIN5ONE
329689727
CC1=NN(C(=O)C1=CC2=CC=C(C=C2)OC)C3=C(C=CC(=C3)Cl)Cl
COc1ccc(cc1)C=C1C(=NN(C1=O)c1cc(Cl)ccc1Cl)C
InChI=1SC18H14Cl2N2O2c11115(9123614(242)7412)18(23)22(2111)171013(19)5816(17)20h310H12H3b159
MFCD00387513
ZINC000004579153
ZINC04579153
ZINC4579153

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Available files

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