Vitas-M small molecule compound
ethyl 4-[3-(2-butoxy-1-cyano-2-oxoethyl)quinoxalin-2-yl]piperazine-1-carboxylate
Catalog ID
STK548391
SMILES CCCCOC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)C(=O)OCC)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 C22H27N5O4 MW 425.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N5O4/c1-3-5-14-31-21(28)16(15-23)19-20(25-18-9-7-6-8-17(18)24-19)26-10-12-27(13-11-26)22(29)30-4-2/h6-9,16H,3-5,10-14H2,1-2H3InChIKey
KSBWULHFWCEKLI-UHFFFAOYSA-NSynonyms
488803-92-5488803925
CCCCOC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCN(CC3)C(=O)OCC
ETHYL4(3((1R)2BUTOXY1CYANO2OXOETHYL)QUINOXALIN2YL)PIPERAZINE1CARBOXYLATE
ETHYL4(3((1S)2BUTOXY1CYANO2OXOETHYL)QUINOXALIN2YL)PIPERAZINE1CARBOXYLATE
ethyl4(3(2butoxy1cyano2oxoethyl)quinoxalin2yl)piperazine1carboxylate
InChI=1SC22H27N5O4c135143121(28)16(1523)1920(2518976817(18)2419)26101227(131126)22(29)3042h6916H351014H212H3
MFCD03293237
ZINC000002318201
ZINC000002318202
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