Vitas-M small molecule compound

butyl 2-methyl-5-oxo-4-(pyridin-4-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK053666
SMILES CCCCOC(=O)C1=C(C)NC2=C(C1c1ccncc1)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 C20H24N2O3 MW 340.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N2O3/c1-3-4-12-25-20(24)17-13(2)22-15-6-5-7-16(23)19(15)18(17)14-8-10-21-11-9-14/h8-11,18,22H,3-7,12H2,1-2H3
InChIKey
GXEZDNIXNUPTLX-UHFFFAOYSA-N
Synonyms

butyl2methyl5oxo4(pyridin4yl)145678hexahydroquinoline3carboxylate
butyl2methyl5oxo4pyridin4yl4678tetrahydro1Hquinoline3carboxylate
CCCCOC(=O)C1=C(C)NC2=C(C1c1ccncc1)C(=O)CCC2
CCCCOC(=O)C1=C(NC2=C(C1C3=CC=NC=C3)C(=O)CCC2)C
InChI=1SC20H24N2O3c134122520(24)1713(2)221565716(23)19(15)18(17)148102111914h8111822H3712H212H3
MFCD00771085
STK053666
ZINC000019855480
ZINC000019855482

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Available files

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