Vitas-M small molecule compound
2-[3-(azepan-1-yl)quinoxalin-2-yl]-2-cyano-N-(4-methoxybenzyl)acetamide
Catalog ID
STL330442
SMILES N#CC(c1nc2ccccc2nc1N1CCCCCC1)C(=O)NCc1ccc(cc1)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 C25H27N5O2 MW 429.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N5O2/c1-32-19-12-10-18(11-13-19)17-27-25(31)20(16-26)23-24(30-14-6-2-3-7-15-30)29-22-9-5-4-8-21(22)28-23/h4-5,8-13,20H,2-3,6-7,14-15,17H2,1H3,(H,27,31)InChIKey
FQBRQMLOGUDGRF-UHFFFAOYSA-NSynonyms
2(3(AZEPAN1YL)QUINOXALIN2YL)2CYANON((4METHOXYPHENYL)METHYL)ACETAMIDE
2(3(azepan1yl)quinoxalin2yl)2cyanoN(4methoxybenzyl)acetamide
COC1=CC=C(C=C1)CNC(=O)C(C#N)C2=NC3=CC=CC=C3N=C2N4CCCCCC4
InChI=1SC25H27N5O2c13219121018(111319)172725(31)20(1626)2324(301462371530)2922954821(22)2823h4581320H2367141517H21H3(H2731)
MFCD02995212
ZINC000002303382
ZINC000002303383
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