Vitas-M small molecule compound

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

Catalog ID
STK396392
SMILES Clc1ccc(c(c1)N1N=C(/C(=C/c2cccc(c2)Br)/C1=O)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 C17H11BrCl2N2O MW 410.10 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H11BrCl2N2O/c1-10-14(8-11-3-2-4-12(18)7-11)17(23)22(21-10)16-9-13(19)5-6-15(16)20/h2-9H,1H3/b14-8-
InChIKey
QEKATLWSRRGBCO-ZSOIEALJSA-N
Synonyms

(4Z)4((3BROMOPHENYL)METHYLIDENE)2(25DICHLOROPHENYL)5METHYLPYRAZOL3ONE
(4Z)4(3bromobenzylidene)2(25dichlorophenyl)5methyl24dihydro3Hpyrazol3one
1(25DICHLOROPHENYL)4((3BROMOPHENYL)METHYLENE)3METHYL12DIAZOLIN5ONE
CC1=NN(C(=O)C1=CC2=CC(=CC=C2)Br)C3=C(C=CC(=C3)Cl)Cl
Clc1ccc(c(c1)N1N=C(C(=Cc2cccc(c2)Br)C1=O)C)Cl
InChI=1SC17H11BrCl2N2Oc11014(81132412(18)711)17(23)22(2110)16913(19)5615(16)20h29H1H3b148
MFCD00397242
ZINC000016102023
ZINC16102023

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Available files

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