dimethyl 5-[2-(2-quinoxalin-2-ylsulfanylethanoyloxy)ethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[2-(2-quinoxalin-2-ylsulfanylethanoyloxy)ethanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[2-(2-quinoxalin-2-ylsulfanylacetyl)oxyacetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[1-oxo-2-[1-oxo-2-(2-quinoxalinylthio)ethoxy]ethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-(2-quinoxalin-2-ylsulfanylacetyl)oxyacetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-[2-(quinoxalin-2-ylthio)acetyl]oxyacetyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C22H19N3O7S MolecularWeight: 469.46716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)COC(=O)CSC2=NC3=CC=CC=C3N=C2)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)COC(=O)CSC2=NC3=CC=CC=C3N=C2)C(=O)OC

InChI

InChI=1S/C22H19N3O7S/c1-30-21(28)13-7-14(22(29)31-2)9-15(8-13)24-18(26)11-32-20(27)12-33-19-10-23-16-5-3-4-6-17(16)25-19/h3-10H,11-12H2,1-2H3,(H,24,26)