Vitas-M small molecule compound

2-methylbutyl cyano[3-(piperidin-1-yl)quinoxalin-2-yl]acetate

Catalog ID
STL146084
SMILES CCC(COC(=O)C(c1nc2ccccc2nc1N1CCCCC1)C#N)C

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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 C21H26N4O2 MW 366.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N4O2/c1-3-15(2)14-27-21(26)16(13-22)19-20(25-11-7-4-8-12-25)24-18-10-6-5-9-17(18)23-19/h5-6,9-10,15-16H,3-4,7-8,11-12,14H2,1-2H3
InChIKey
WQQIXFOUKOQUCN-UHFFFAOYSA-N
Synonyms
573696-79-4
(2R)2METHYLBUTYL(2R)CYANO(3(PIPERIDIN1YL)QUINOXALIN2YL)ETHANOATE
(2R)2METHYLBUTYL(2S)CYANO(3(PIPERIDIN1YL)QUINOXALIN2YL)ETHANOATE
(2S)2METHYLBUTYL(2S)CYANO(3(PIPERIDIN1YL)QUINOXALIN2YL)ETHANOATE
2CYANO2(3(1PIPERIDINYL)2QUINOXALINYL)ACETICACID2METHYLBUTYLESTER
2CYANO2(3PIPERIDINOQUINOXALIN2YL)ACETICACID2METHYLBUTYLESTER
2METHYLBUTYL2CYANO2(3(PIPERIDIN1YL)QUINOXALIN2YL)ACETATE
2METHYLBUTYL2CYANO2(3PIPERIDIN1YLQUINOXALIN2YL)ACETATE
2METHYLBUTYL2CYANO2(3PIPERIDIN1YLQUINOXALIN2YL)ETHANOATE
2methylbutylcyano(3(piperidin1yl)quinoxalin2yl)acetate
573696794
CCC(C)COC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCCCC3
InChI=1SC21H26N4O2c1315(2)142721(26)16(1322)1920(25117481225)24181065917(18)2319h569101516H3478111214H212H3
MFCD04017787
ZINC000002367030
ZINC000002367036

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Available files

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