Vitas-M small molecule compound

ethyl 4-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK316014
SMILES CCOC(=O)C1=C(C)NC2=C(C1c1cn(nc1C)CC)C(=O)CCC2

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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 C19H25N3O3 MW 343.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H25N3O3/c1-5-22-10-13(11(3)21-22)17-16(19(24)25-6-2)12(4)20-14-8-7-9-15(23)18(14)17/h10,17,20H,5-9H2,1-4H3
InChIKey
QQEVKGHMFNPWIP-UHFFFAOYSA-N
Synonyms
492425-54-4
492425544
CCN1C=C(C(=N1)C)C2C3=C(CCCC3=O)NC(=C2C(=O)OCC)C
ethyl4(1ethyl3methyl1Hpyrazol4yl)2methyl5oxo145678hexahydroquinoline3carboxylate
ethyl4(1ethyl3methylpyrazol4yl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
InChI=1SC19H25N3O3c15221013(11(3)2122)1716(19(24)2562)12(4)201487915(23)18(14)17h101720H59H214H3
MFCD02175361
ZINC000005728190
ZINC000005728196

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Available files

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