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

Systemtic Name: [2-oxidanylidene-2-[[4-(pyrimidin-2-ylsulfamoyl)phenyl]amino]ethyl] quinoxaline-2-carboxylate Openeye Name: [2-oxo-2-[4-(pyrimidin-2-ylsulfamoyl)anilino]ethyl] quinoxaline-2-carboxylate CAS Name: 2-quinoxalinecarboxylic acid [2-oxo-2-[4-(2-pyrimidinylsulfamoyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-[4-(pyrimidin-2-ylsulfamoyl)anilino]ethyl] quinoxaline-2-carboxylate Traditional Name: quinoxaline-2-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/c28-19(13-32-20(29)18-12-24-16-4-1-2-5-17(16)26-18)25-14-6-8-15(9-7-14)33(30,31)27-21-22-10-3-11-23-21/h1-12H,13H2,(H,25,28)(H,22,23,27)