Vitas-M small molecule compound
2-{[3-(4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-5,5-dimethylcyclohexane-1,3-dione
Catalog ID
STK702414
SMILES COc1ccc(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 C25H24N2O3 MW 400.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N2O3/c1-25(2)14-22(28)21(23(29)15-25)13-18-16-27(19-7-5-4-6-8-19)26-24(18)17-9-11-20(30-3)12-10-17/h4-13,16H,14-15H2,1-3H3InChIKey
DIRJVRPCQAPXOD-UHFFFAOYSA-NSynonyms
313049-75-12((3(4methoxyphenyl)1phenyl1Hpyrazol4yl)methylene)55dimethylcyclohexane13dione
2((3(4methoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)55dimethylcyclohexane13dione
2((3(4METHOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)55DIMETHYLCYCLOHEXANE13DIONE
313049751
CC1(CC(=O)C(=CC2=CN(N=C2C3=CC=C(C=C3)OC)C4=CC=CC=C4)C(=O)C1)C
InChI=1SC25H24N2O3c125(2)1422(28)21(23(29)1525)13181627(197546819)2624(18)1791120(303)121017h41316H1415H213H3
MFCD01952304
ZINC000001463428
ZINC01463428
ZINC1463428
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