Vitas-M small molecule compound
2-{3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]quinoxalin-2-yl}-2-cyano-N-hexylacetamide
Catalog ID
STK533888
SMILES CCCCCCNC(=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 C29H34N6O3 MW 514.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34N6O3/c1-2-3-4-7-12-31-29(36)22(18-30)27-28(33-24-9-6-5-8-23(24)32-27)35-15-13-34(14-16-35)19-21-10-11-25-26(17-21)38-20-37-25/h5-6,8-11,17,22H,2-4,7,12-16,19-20H2,1H3,(H,31,36)InChIKey
VOVAPRHGZUJWEP-UHFFFAOYSA-NSynonyms
2(3(4(13benzodioxol5ylmethyl)piperazin1yl)quinoxalin2yl)2cyanoNhexylacetamide
2(3(4(benzo(d)(13)dioxol5ylmethyl)piperazin1yl)quinoxalin2yl)2cyanoNhexylacetamide
CCCCCCNC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCN(CC3)CC4=CC5=C(C=C4)OCO5
InChI=1SC29H34N6O3c12347123129(36)22(1830)2728(3324965823(24)3227)35151334(141635)192110112526(1721)38203725h568111722H24712161920H21H3(H3136)
MFCD02988979
ZINC000013800051
ZINC000057054022
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