Vitas-M small molecule compound

ethyl 1-[(2E)-3-(4-methylphenyl)-2-(2-oxopyridin-1(2H)-yl)prop-2-enoyl]piperidine-3-carboxylate

Catalog ID
STK103589
SMILES CCOC(=O)C1CCCN(C1)C(=O)/C(=C\c1ccc(cc1)C)/n1ccccc1=O

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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 C23H26N2O4 MW 394.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N2O4/c1-3-29-23(28)19-7-6-13-24(16-19)22(27)20(25-14-5-4-8-21(25)26)15-18-11-9-17(2)10-12-18/h4-5,8-12,14-15,19H,3,6-7,13,16H2,1-2H3/b20-15+
InChIKey
YCIPNITVXCWISF-HMMYKYKNSA-N
Synonyms

CCOC(=O)C1CCCN(C1)C(=O)C(=Cc1ccc(cc1)C)n1ccccc1=O
CCOC(=O)C1CCCN(C1)C(=O)C(=CC2=CC=C(C=C2)C)N3C=CC=CC3=O
ETHYL1((2E)3(4METHYLPHENYL)2(2OXOPYRIDIN1(2H)YL)PROP2ENOYL)PIPERIDINE3CARBOXYLATE
ethyl1((E)3(4methylphenyl)2(2oxopyridin1yl)prop2enoyl)piperidine3carboxylate
InChI=1SC23H26N2O4c132923(28)19761324(1619)22(27)20(251454821(25)26)151811917(2)101218h45812141519H3671316H212H3b2015+
MFCD09267255
ZINC000012463854
ZINC000012463858

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Available files

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