Vitas-M small molecule compound
cyclohexyl cyano{3-[4-(2,3-dimethylphenyl)piperazin-1-yl]quinoxalin-2-yl}acetate
Catalog ID
STK714383
SMILES N#CC(c1nc2ccccc2nc1N1CCN(CC1)c1cccc(c1C)C)C(=O)OC1CCCCC1
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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 C29H33N5O2 MW 483.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33N5O2/c1-20-9-8-14-26(21(20)2)33-15-17-34(18-16-33)28-27(31-24-12-6-7-13-25(24)32-28)23(19-30)29(35)36-22-10-4-3-5-11-22/h6-9,12-14,22-23H,3-5,10-11,15-18H2,1-2H3InChIKey
XMUBVLUNICWCBP-UHFFFAOYSA-NSynonyms
577787-18-9577787189
CC1=C(C(=CC=C1)N2CCN(CC2)C3=NC4=CC=CC=C4N=C3C(C#N)C(=O)OC5CCCCC5)C
CYCLOHEXYL2CYANO2(3(4(23DIMETHYLPHENYL)PIPERAZIN1YL)QUINOXALIN2YL)ACETATE
cyclohexylcyano(3(4(23dimethylphenyl)piperazin1yl)quinoxalin2yl)acetate
InChI=1SC29H33N5O2c120981426(21(20)2)33151734(181633)2827(312412671325(24)3228)23(1930)29(35)3622104351122h6912142223H3510111518H212H3
MFCD04026990
ZINC000008980307
ZINC000008980308
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