Vitas-M small molecule compound

3,5-bis(3,4-dimethylphenyl)-1-(2-ethylphenyl)-4-methyl-1H-pyrazole

Catalog ID
STK314212
SMILES CCc1ccccc1n1nc(c(c1c1ccc(c(c1)C)C)C)c1ccc(c(c1)C)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 C28H30N2 MW 394.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N2/c1-7-23-10-8-9-11-26(23)30-28(25-15-13-19(3)21(5)17-25)22(6)27(29-30)24-14-12-18(2)20(4)16-24/h8-17H,7H2,1-6H3
InChIKey
RDBSURLAVHJHTO-UHFFFAOYSA-N
Synonyms
1006346-78-6
1006346786
35bis(34dimethylphenyl)1(2ethylphenyl)4methyl1Hpyrazole
35bis(34dimethylphenyl)1(2ethylphenyl)4methylpyrazole
CCC1=CC=CC=C1N2C(=C(C(=N2)C3=CC(=C(C=C3)C)C)C)C4=CC(=C(C=C4)C)C
InChI=1SC28H30N2c172310891126(23)3028(25151319(3)21(5)1725)22(6)27(2930)24141218(2)20(4)1624h817H7H216H3
MFCD08552721
ZINC000013960814
ZINC13960814

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Available files

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