Vitas-M small molecule compound

2-methyl-1-[3-phenyl-5-(quinoxalin-6-yl)-4,5-dihydro-1H-pyrazol-1-yl]propan-1-one

Catalog ID
STK857070
SMILES O=C(N1N=C(CC1c1ccc2c(c1)nccn2)c1ccccc1)C(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 C21H20N4O MW 344.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O/c1-14(2)21(26)25-20(13-18(24-25)15-6-4-3-5-7-15)16-8-9-17-19(12-16)23-11-10-22-17/h3-12,14,20H,13H2,1-2H3
InChIKey
YGTFXHPWBAIJHZ-UHFFFAOYSA-N
Synonyms
946201-79-2
2methyl1(3phenyl5(quinoxalin6yl)45dihydro1Hpyrazol1yl)propan1one
2methyl1(5phenyl3quinoxalin6yl34dihydropyrazol2yl)propan1one
946201792
CC(C)C(=O)N1C(CC(=N1)C2=CC=CC=C2)C3=CC4=NC=CN=C4C=C3
InChI=1SC21H20N4Oc114(2)21(26)2520(1318(2425)156435715)16891719(1216)2311102217h3121420H13H212H3
MFCD09853605
ZINC000012420850
ZINC000012420852

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Available files

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