Vitas-M small molecule compound

2-methoxy-1-[5-(quinoxalin-6-yl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]ethanone

Catalog ID
STK937428
SMILES COCC(=O)N1N=C(CC1c1ccc2c(c1)nccn2)c1cccs1

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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 C18H16N4O2S MW 352.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N4O2S/c1-24-11-18(23)22-16(10-15(21-22)17-3-2-8-25-17)12-4-5-13-14(9-12)20-7-6-19-13/h2-9,16H,10-11H2,1H3
InChIKey
LBGYPOCDEZDRIW-UHFFFAOYSA-N
Synonyms
1232791-56-8
1232791568
2methoxy1(3quinoxalin6yl5thiophen2yl34dihydropyrazol2yl)ethanone
2methoxy1(5(quinoxalin6yl)3(thiophen2yl)45dihydro1Hpyrazol1yl)ethanone
COCC(=O)N1C(CC(=N1)C2=CC=CS2)C3=CC4=NC=CN=C4C=C3
InChI=1SC18H16N4O2Sc1241118(23)2216(1015(2122)173282517)12451314(912)20761913h2916H1011H21H3
MFCD17925939
ZINC000044902804
ZINC000044902807

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Available files

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