Vitas-M small molecule compound

[1-(3,4-dimethylphenyl)-1H-1,2,3-triazol-4-yl](4-phenyl-3,6-dihydropyridin-1(2H)-yl)methanone

Catalog ID
STL127446
SMILES O=C(c1nnn(c1)c1ccc(c(c1)C)C)N1CCC(=CC1)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 C22H22N4O MW 358.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O/c1-16-8-9-20(14-17(16)2)26-15-21(23-24-26)22(27)25-12-10-19(11-13-25)18-6-4-3-5-7-18/h3-10,14-15H,11-13H2,1-2H3
InChIKey
WDBJOCURZQYIRU-UHFFFAOYSA-N
Synonyms
1326882-07-8
(1(34dimethylphenyl)1H123triazol4yl)(4phenyl36dihydropyridin1(2H)yl)methanone
(1(34dimethylphenyl)triazol4yl)(4phenyl36dihydro2Hpyridin1yl)methanone
1326882078
CC1=C(C=C(C=C1)N2C=C(N=N2)C(=O)N3CCC(=CC3)C4=CC=CC=C4)C
InChI=1SC22H22N4Oc1168920(1417(16)2)261521(232426)22(27)25121019(111325)186435718h3101415H1113H212H3
MFCD20740358
ZINC000067263021
ZINC67263021

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Available files

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