[2-oxidanylidene-2-[[4-(pyrimidin-2-ylsulfamoyl)phenyl]amino]ethyl] quinoxaline-5-carboxylate

Systemtic Name: [2-oxidanylidene-2-[[4-(pyrimidin-2-ylsulfamoyl)phenyl]amino]ethyl] quinoxaline-5-carboxylate Openeye Name: [2-oxo-2-[4-(pyrimidin-2-ylsulfamoyl)anilino]ethyl] quinoxaline-5-carboxylate CAS Name: 5-quinoxalinecarboxylic acid [2-oxo-2-[4-(2-pyrimidinylsulfamoyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-[4-(pyrimidin-2-ylsulfamoyl)anilino]ethyl] quinoxaline-5-carboxylate Traditional Name: quinoxaline-5-carboxylic acid [2-keto-2-[4-(2-pyrimidylsulfamoyl)anilino]ethyl] ester Formula: C21H16N6O5S MolecularWeight: 464.45394

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)N=CC=N2)C(=O)OCC(=O)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4

Isomeric SMILES

C1=CC(=C2C(=C1)N=CC=N2)C(=O)OCC(=O)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4

InChI

InChI=1S/C21H16N6O5S/c28-18(13-32-20(29)16-3-1-4-17-19(16)23-12-11-22-17)26-14-5-7-15(8-6-14)33(30,31)27-21-24-9-2-10-25-21/h1-12H,13H2,(H,26,28)(H,24,25,27)