Vitas-M small molecule compound
3-[5-(2-hydroxyphenyl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-5,5-dimethylcyclohex-2-en-1-one
Catalog ID
STL200417
SMILES O=C1C=C(CC(C1)(C)C)N1N=C(CC1c1ccccc1O)c1ccc(cc1)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 C24H26N2O2 MW 374.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N2O2/c1-16-8-10-17(11-9-16)21-13-22(20-6-4-5-7-23(20)28)26(25-21)18-12-19(27)15-24(2,3)14-18/h4-12,22,28H,13-15H2,1-3H3InChIKey
KWJDSQMXMFBSAF-UHFFFAOYSA-NSynonyms
3(3(2hydroxyphenyl)5(4methylphenyl)34dihydropyrazol2yl)55dimethylcyclohex2en1one
3(5(2hydroxyphenyl)3(4methylphenyl)45dihydro1Hpyrazol1yl)55dimethylcyclohex2en1one
CC1=CC=C(C=C1)C2=NN(C(C2)C3=CC=CC=C3O)C4=CC(=O)CC(C4)(C)C
InChI=1SC24H26N2O2c11681017(11916)211322(20645723(20)28)26(2521)181219(27)1524(23)1418h4122228H1315H213H3
MFCD24858201
ZINC000080325289
ZINC000080325293
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