Vitas-M small molecule compound

1-[3-(4-ethoxyphenyl)-5-(quinoxalin-6-yl)-4,5-dihydro-1H-pyrazol-1-yl]ethanone

Catalog ID
STK857401
SMILES CCOc1ccc(cc1)C1=NN(C(C1)c1ccc2c(c1)nccn2)C(=O)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 C21H20N4O2 MW 360.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O2/c1-3-27-17-7-4-15(5-8-17)19-13-21(25(24-19)14(2)26)16-6-9-18-20(12-16)23-11-10-22-18/h4-12,21H,3,13H2,1-2H3
InChIKey
LBXFDXOGZUTPSC-UHFFFAOYSA-N
Synonyms
1010931-75-5
1(3(4ethoxyphenyl)5(quinoxalin6yl)45dihydro1Hpyrazol1yl)ethanone
1(5(4ethoxyphenyl)3quinoxalin6yl34dihydropyrazol2yl)ethanone
1010931755
CCOC1=CC=C(C=C1)C2=NN(C(C2)C3=CC4=NC=CN=C4C=C3)C(=O)C
InChI=1SC21H20N4O2c1327177415(5817)191321(25(2419)14(2)26)16691820(1216)2311102218h41221H313H212H3
MFCD10649527
ZINC000012409914
ZINC000012409915

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Available files

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