Vitas-M small molecule compound

2-methoxyethyl {3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]quinoxalin-2-yl}(cyano)acetate

Catalog ID
STL241277
SMILES COCCOC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)Cc1ccc2c(c1)OCO2)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 C26H27N5O5 MW 489.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N5O5/c1-33-12-13-34-26(32)19(15-27)24-25(29-21-5-3-2-4-20(21)28-24)31-10-8-30(9-11-31)16-18-6-7-22-23(14-18)36-17-35-22/h2-7,14,19H,8-13,16-17H2,1H3
InChIKey
RKDUNCGYTRJALJ-UHFFFAOYSA-N
Synonyms
488745-42-2
2methoxyethyl(3(4(13benzodioxol5ylmethyl)piperazin1yl)quinoxalin2yl)(cyano)acetate
2METHOXYETHYL2(3(4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)QUINOXALIN2YL)2CYANOACETATE
2methoxyethyl2(3(4(benzo(d)(13)dioxol5ylmethyl)piperazin1yl)quinoxalin2yl)2cyanoacetate
488745422
COCCOC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCN(CC3)CC4=CC5=C(C=C4)OCO5
InChI=1SC26H27N5O5c13312133426(32)19(1527)2425(2921532420(21)2824)3110830(91131)1618672223(1418)36173522h271419H8131617H21H3
MFCD03292291
ZINC000013564591
ZINC000013564592

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Available files

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