Vitas-M small molecule compound

2-methylbutyl cyano[3-(4-ethylpiperazin-1-yl)quinoxalin-2-yl]acetate

Catalog ID
STL226024
SMILES CCC(COC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)CC)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 C22H29N5O2 MW 395.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29N5O2/c1-4-16(3)15-29-22(28)17(14-23)20-21(27-12-10-26(5-2)11-13-27)25-19-9-7-6-8-18(19)24-20/h6-9,16-17H,4-5,10-13,15H2,1-3H3
InChIKey
FVDICPYKECYOPI-UHFFFAOYSA-N
Synonyms
586984-87-4
(2R)2METHYLBUTYL(2S)CYANO(3(4ETHYLPIPERAZIN1YL)QUINOXALIN2YL)ETHANOATE
(2S)2METHYLBUTYL(2R)CYANO(3(4ETHYLPIPERAZIN1YL)QUINOXALIN2YL)ETHANOATE
(2S)2METHYLBUTYL(2S)CYANO(3(4ETHYLPIPERAZIN1YL)QUINOXALIN2YL)ETHANOATE
2METHYLBUTYL2CYANO2(3(4ETHYLPIPERAZIN1YL)QUINOXALIN2YL)ACETATE
2methylbutylcyano(3(4ethylpiperazin1yl)quinoxalin2yl)acetate
586984874
CCC(C)COC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCN(CC3)CC
InChI=1SC22H29N5O2c1416(3)152922(28)17(1423)2021(27121026(52)111327)2519976818(19)2420h691617H45101315H213H3
MFCD04031017
ZINC000002393949
ZINC000002393952

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Available files

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