Vitas-M small molecule compound
heptyl cyano(3-{4-[(E)-2-phenylethenyl]piperazin-1-yl}quinoxalin-2-yl)acetate
Catalog ID
STK920538
SMILES CCCCCCCOC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)/C=C/c1ccccc1)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 C30H35N5O2 MW 497.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H35N5O2/c1-2-3-4-5-11-22-37-30(36)25(23-31)28-29(33-27-15-10-9-14-26(27)32-28)35-20-18-34(19-21-35)17-16-24-12-7-6-8-13-24/h6-10,12-17,25H,2-5,11,18-22H2,1H3/b17-16+InChIKey
RZIDOUNDDIJKBL-WUKNDPDISA-NSynonyms
585561-35-9(E)heptyl2cyano2(3(4styrylpiperazin1yl)quinoxalin2yl)acetate
585561359
CCCCCCCOC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCN(CC3)C=CC4=CC=CC=C4
CCCCCCCOC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)C=Cc1ccccc1)C#N
HEPTYL2CYANO2(3(4((E)2PHENYLETHENYL)PIPERAZIN1YL)QUINOXALIN2YL)ACETATE
heptylcyano(3(4((E)2phenylethenyl)piperazin1yl)quinoxalin2yl)acetate
InChI=1SC30H35N5O2c1234511223730(36)25(2331)2829(3327151091426(27)3228)35201834(192135)171624127681324h610121725H25111822H21H3b1716+
MFCD04030695
ZINC000097954002
ZINC000097954003
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