Vitas-M small molecule compound

ethyl 4-[({1-[(4-chlorophenoxy)acetyl]-3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl}acetyl)amino]benzoate

Catalog ID
STK822697
SMILES CCOC(=O)c1ccc(cc1)NC(=O)CC1C(=O)Nc2c(N1C(=O)COc1ccc(cc1)Cl)cccc2

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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 C27H24ClN3O6 MW 521.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24ClN3O6/c1-2-36-27(35)17-7-11-19(12-8-17)29-24(32)15-23-26(34)30-21-5-3-4-6-22(21)31(23)25(33)16-37-20-13-9-18(28)10-14-20/h3-14,23H,2,15-16H2,1H3,(H,29,32)(H,30,34)
InChIKey
STQUMPIZMGOBBQ-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CC=C(C=C1)NC(=O)CC2C(=O)NC3=CC=CC=C3N2C(=O)COC4=CC=C(C=C4)Cl
ethyl4(((1((4chlorophenoxy)acetyl)3oxo1234tetrahydroquinoxalin2yl)acetyl)amino)benzoate
ethyl4((2(1(2(4chlorophenoxy)acetyl)3oxo24dihydroquinoxalin2yl)acetyl)amino)benzoate
InChI=1SC27H24ClN3O6c123627(35)1771119(12817)2924(32)152326(34)3021534622(21)31(23)25(33)16372013918(28)101420h31423H21516H21H3(H2932)(H3034)
MFCD03212308
ZINC000026688530
ZINC000026688534

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Available files

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