Vitas-M small molecule compound

N-benzyl-2-[3-(4-benzylpiperazin-1-yl)quinoxalin-2-yl]-2-cyanoacetamide

Catalog ID
STK533309
SMILES N#CC(c1nc2ccccc2nc1N1CCN(CC1)Cc1ccccc1)C(=O)NCc1ccccc1

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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 C29H28N6O MW 476.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N6O/c30-19-24(29(36)31-20-22-9-3-1-4-10-22)27-28(33-26-14-8-7-13-25(26)32-27)35-17-15-34(16-18-35)21-23-11-5-2-6-12-23/h1-14,24H,15-18,20-21H2,(H,31,36)
InChIKey
YXEDHNRSSNKIGP-UHFFFAOYSA-N
Synonyms

C1CN(CCN1CC2=CC=CC=C2)C3=NC4=CC=CC=C4N=C3C(C#N)C(=O)NCC5=CC=CC=C5
InChI=1SC29H28N6Oc301924(29(36)31202293141022)2728(332614871325(26)3227)35171534(161835)2123115261223h11424H15182021H2(H3136)
MFCD02994806
Nbenzyl2(3(4benzylpiperazin1yl)quinoxalin2yl)2cyanoacetamide
ZINC000057054006
ZINC000057054007

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.