Vitas-M small molecule compound

methyl cyano[3-(pyrrolidin-1-yl)quinoxalin-2-yl]acetate

Catalog ID
STL333164
SMILES N#CC(c1nc2ccccc2nc1N1CCCC1)C(=O)OC

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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 C16H16N4O2 MW 296.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4O2/c1-22-16(21)11(10-17)14-15(20-8-4-5-9-20)19-13-7-3-2-6-12(13)18-14/h2-3,6-7,11H,4-5,8-9H2,1H3
InChIKey
ZJGAXVGKIMESIE-UHFFFAOYSA-N
Synonyms
487024-95-3
487024953
COC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCCC3
InChI=1SC16H16N4O2c12216(21)11(1017)1415(20845920)1913732612(13)1814h236711H4589H21H3
methyl2cyano2(3(pyrrolidin1yl)quinoxalin2yl)acetate
METHYL2CYANO2(3PYRROLIDIN1YLQUINOXALIN2YL)ACETATE
methylcyano(3(pyrrolidin1yl)quinoxalin2yl)acetate
MFCD03286658
ZINC000000548612
ZINC000000548613

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Available files

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