Vitas-M small molecule compound
{3-[4-(2,3-dimethylphenyl)piperazin-1-yl]quinoxalin-2-yl}(phenylsulfonyl)acetonitrile
Catalog ID
STK714428
SMILES N#CC(S(=O)(=O)c1ccccc1)c1nc2ccccc2nc1N1CCN(CC1)c1cccc(c1C)C
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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 C28H27N5O2S MW 497.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N5O2S/c1-20-9-8-14-25(21(20)2)32-15-17-33(18-16-32)28-27(30-23-12-6-7-13-24(23)31-28)26(19-29)36(34,35)22-10-4-3-5-11-22/h3-14,26H,15-18H2,1-2H3InChIKey
LONRXGWKKRTBEW-UHFFFAOYSA-NSynonyms
844451-03-2(3(4(23dimethylphenyl)piperazin1yl)quinoxalin2yl)(phenylsulfonyl)acetonitrile
2(3(4(23dimethylphenyl)piperazin1yl)quinoxalin2yl)2(phenylsulfonyl)acetonitrile
2(BENZENESULFONYL)2(3(4(23DIMETHYLPHENYL)PIPERAZIN1YL)QUINOXALIN2YL)ACETONITRILE
844451032
CC1=C(C(=CC=C1)N2CCN(CC2)C3=NC4=CC=CC=C4N=C3C(C#N)S(=O)(=O)C5=CC=CC=C5)C
InChI=1SC28H27N5O2Sc120981425(21(20)2)32151733(181632)2827(302312671324(23)3128)26(1929)36(3435)22104351122h31426H1518H212H3
MFCD04155894
ZINC000009240676
ZINC000009240677
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