Vitas-M small molecule compound

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

Catalog ID
STK377089
SMILES CCOC(=O)C1=C(C)NC2=C(C1c1ccccn1)C(=O)CC(C2)c1ccc(cc1)OC

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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 C25H26N2O4 MW 418.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N2O4/c1-4-31-25(29)22-15(2)27-20-13-17(16-8-10-18(30-3)11-9-16)14-21(28)23(20)24(22)19-7-5-6-12-26-19/h5-12,17,24,27H,4,13-14H2,1-3H3
InChIKey
QDOHZHBCRIYWGA-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(NC2=C(C1C3=CC=CC=N3)C(=O)CC(C2)C4=CC=C(C=C4)OC)C
ethyl7(4methoxyphenyl)2methyl5oxo4(pyridin2yl)145678hexahydroquinoline3carboxylate
ethyl7(4methoxyphenyl)2methyl5oxo4pyridin2yl4678tetrahydro1Hquinoline3carboxylate
InChI=1SC25H26N2O4c143125(29)2215(2)27201317(1681018(303)11916)1421(28)23(20)24(22)19756122619h512172427H41314H213H3
MFCD01445599
ZINC000019770276
ZINC000019770279

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Available files

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