Vitas-M small molecule compound

cycloheptyl 4-(2,3-difluorophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate

Catalog ID
STK407760
SMILES O=C(C1=C(C)NC(=O)CC1c1cccc(c1F)F)OC1CCCCCC1

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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 C20H23F2NO3 MW 363.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23F2NO3/c1-12-18(20(25)26-13-7-4-2-3-5-8-13)15(11-17(24)23-12)14-9-6-10-16(21)19(14)22/h6,9-10,13,15H,2-5,7-8,11H2,1H3,(H,23,24)
InChIKey
PXSRXBKNWMEKJI-UHFFFAOYSA-N
Synonyms

CC1=C(C(CC(=O)N1)C2=C(C(=CC=C2)F)F)C(=O)OC3CCCCCC3
cycloheptyl4(23difluorophenyl)2methyl6oxo1456tetrahydropyridine3carboxylate
CYCLOHEPTYL4(23DIFLUOROPHENYL)2METHYL6OXO145TRIHYDROPYRIDINE3CARBOXYLATE
cycloheptyl4(23difluorophenyl)6methyl2oxo34dihydro1Hpyridine5carboxylate
InChI=1SC20H23F2NO3c11218(20(25)261374235813)15(1117(24)2312)14961016(21)19(14)22h69101315H257811H21H3(H2324)
MFCD08133450
ZINC000006820038
ZINC000006820041

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Available files

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