2-nitro-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzenesulfonamide

Systemtic Name: 2-nitro-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzenesulfonamide Openeye Name: 2-nitro-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzenesulfonamide CAS Name: 2-nitro-N-[4-(2-pyrimidinylsulfamoyl)phenyl]benzenesulfonamide IUPAC Name: 2-nitro-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzenesulfonamide Traditional Name: 2-nitro-N-[4-(2-pyrimidylsulfamoyl)phenyl]benzenesulfonamide Formula: C16H13N5O6S2 MolecularWeight: 435.43432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3

Isomeric SMILES

C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3

InChI

InChI=1S/C16H13N5O6S2/c22-21(23)14-4-1-2-5-15(14)29(26,27)19-12-6-8-13(9-7-12)28(24,25)20-16-17-10-3-11-18-16/h1-11,19H,(H,17,18,20)