Vitas-M small molecule compound
2-{3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]quinoxalin-2-yl}-N-butyl-2-cyanoacetamide
Catalog ID
STL330342
SMILES CCCCNC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)Cc1ccc2c(c1)OCO2)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 C27H30N6O3 MW 486.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N6O3/c1-2-3-10-29-27(34)20(16-28)25-26(31-22-7-5-4-6-21(22)30-25)33-13-11-32(12-14-33)17-19-8-9-23-24(15-19)36-18-35-23/h4-9,15,20H,2-3,10-14,17-18H2,1H3,(H,29,34)InChIKey
SGMZDYQNFLEUME-UHFFFAOYSA-NSynonyms
2(3(4(13benzodioxol5ylmethyl)piperazin1yl)quinoxalin2yl)Nbutyl2cyanoacetamide
2(3(4(benzo(d)(13)dioxol5ylmethyl)piperazin1yl)quinoxalin2yl)Nbutyl2cyanoacetamide
CCCCNC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCN(CC3)CC4=CC5=C(C=C4)OCO5
InChI=1SC27H30N6O3c123102927(34)20(1628)2526(3122754621(22)3025)33131132(121433)1719892324(1519)36183523h491520H2310141718H21H3(H2934)
MFCD02994031
ZINC000061715014
ZINC000061715015
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