Vitas-M small molecule compound
1-(azepan-1-yl)-2-{[3-(4-methylpiperazin-1-yl)quinoxalin-2-yl]sulfanyl}ethanone
Catalog ID
STK506906
SMILES CN1CCN(CC1)c1nc2ccccc2nc1SCC(=O)N1CCCCCC1
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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 C21H29N5OS MW 399.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29N5OS/c1-24-12-14-26(15-13-24)20-21(23-18-9-5-4-8-17(18)22-20)28-16-19(27)25-10-6-2-3-7-11-25/h4-5,8-9H,2-3,6-7,10-16H2,1H3InChIKey
PQHBSCHNBICNOF-UHFFFAOYSA-NSynonyms
1(azepan1yl)2((3(4methylpiperazin1yl)quinoxalin2yl)sulfanyl)ethanone
1(azepan1yl)2(3(4methylpiperazin1yl)quinoxalin2yl)sulfanylethanone
1AZAPERHYDROEPINYL2(3(4METHYLPIPERAZINYL)QUINOXALIN2YLTHIO)ETHAN1ONE
CN1CCN(CC1)C2=NC3=CC=CC=C3N=C2SCC(=O)N4CCCCCC4
InChI=1SC21H29N5OSc124121426(151324)2021(2318954817(18)2220)281619(27)251062371125h4589H23671016H21H3
MFCD13369029
ZINC000035655301
ZINC35655301
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