Vitas-M small molecule compound
1-methoxypropan-2-yl {3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]quinoxalin-2-yl}(cyano)acetate
Catalog ID
STK548156
SMILES COCC(OC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)Cc1ccc2c(c1)OCO2)C#N)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 C27H29N5O5 MW 503.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N5O5/c1-18(16-34-2)37-27(33)20(14-28)25-26(30-22-6-4-3-5-21(22)29-25)32-11-9-31(10-12-32)15-19-7-8-23-24(13-19)36-17-35-23/h3-8,13,18,20H,9-12,15-17H2,1-2H3InChIKey
GEKQBGNRBCZKSD-UHFFFAOYSA-NSynonyms
489423-24-71methoxypropan2yl(3(4(13benzodioxol5ylmethyl)piperazin1yl)quinoxalin2yl)(cyano)acetate
1METHOXYPROPAN2YL2(3(4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)QUINOXALIN2YL)2CYANOACETATE
1methoxypropan2yl2(3(4(benzo(d)(13)dioxol5ylmethyl)piperazin1yl)quinoxalin2yl)2cyanoacetate
489423247
CC(COC)OC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCN(CC3)CC4=CC5=C(C=C4)OCO5
InChI=1SC27H29N5O5c118(16342)3727(33)20(1428)2526(3022643521(22)2925)3211931(101232)1519782324(1319)36173523h38131820H9121517H212H3
MFCD03296849
ZINC000057063748
ZINC000057063751
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