Vitas-M small molecule compound

2-{[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-5,5-dimethylcyclohexane-1,3-dione

Catalog ID
STK701730
SMILES Clc1ccc(cc1)c1nn(cc1C=C1C(=O)CC(CC1=O)(C)C)c1ccccc1

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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 C24H21ClN2O2 MW 404.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21ClN2O2/c1-24(2)13-21(28)20(22(29)14-24)12-17-15-27(19-6-4-3-5-7-19)26-23(17)16-8-10-18(25)11-9-16/h3-12,15H,13-14H2,1-2H3
InChIKey
CCVYYARDAZOYCG-UHFFFAOYSA-N
Synonyms
313273-04-0
2((3(4CHLOROPHENYL)1PHENYL1HPYRAZOL4YL)METHYLENE)55DIMETHYL13CYCLOHEXANEDIONE
2((3(4chlorophenyl)1phenyl1Hpyrazol4yl)methylene)55dimethylcyclohexane13dione
2((3(4chlorophenyl)1phenyl1Hpyrazol4yl)methylidene)55dimethylcyclohexane13dione
2((3(4CHLOROPHENYL)1PHENYL4PYRAZOLYL)METHYLIDENE)55DIMETHYLCYCLOHEXANE13DIONE
2((3(4CHLOROPHENYL)1PHENYLPYRAZOL4YL)METHYLENE)55DIMETHYLCYCLOHEXANE13QUINONE
2((3(4CHLOROPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)55DIMETHYLCYCLOHEXANE13DIONE
313273040
CC1(CC(=O)C(=CC2=CN(N=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4)C(=O)C1)C
InChI=1SC24H21ClN2O2c124(2)1321(28)20(22(29)1424)12171527(196435719)2623(17)1681018(25)11916h31215H1314H212H3
MFCD01954651
ZINC000001181900
ZINC01181900
ZINC1181900

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Available files

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