Vitas-M small molecule compound

methyl 1-(3-{1-cyano-2-[(furan-2-ylmethyl)amino]-2-oxoethyl}quinoxalin-2-yl)piperidine-4-carboxylate

Catalog ID
STK990751
SMILES COC(=O)C1CCN(CC1)c1nc2ccccc2nc1C(C(=O)NCc1ccco1)C#N

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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 C23H23N5O4 MW 433.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N5O4/c1-31-23(30)15-8-10-28(11-9-15)21-20(26-18-6-2-3-7-19(18)27-21)17(13-24)22(29)25-14-16-5-4-12-32-16/h2-7,12,15,17H,8-11,14H2,1H3,(H,25,29)
InChIKey
IBYOEXNLJGLDAS-UHFFFAOYSA-N
Synonyms

COC(=O)C1CCN(CC1)C2=NC3=CC=CC=C3N=C2C(C#N)C(=O)NCC4=CC=CO4
InChI=1SC23H23N5O4c13123(30)1581028(11915)2120(2618623719(18)2721)17(1324)22(29)25141654123216h27121517H81114H21H3(H2529)
methyl1(3(1cyano2((furan2ylmethyl)amino)2oxoethyl)quinoxalin2yl)piperidine4carboxylate
methyl1(3(1cyano2(furan2ylmethylamino)2oxoethyl)quinoxalin2yl)piperidine4carboxylate
MFCD08161747
ZINC000008834453
ZINC000008834454

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Available files

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