N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[4-(2-pyrimidinylsulfamoyl)phenyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[4-(2-pyrimidylsulfamoyl)phenyl]piazthiole-4-sulfonamide Formula: C16H12N6O4S3 MolecularWeight: 448.49928

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NSN=C2C(=C1)S(=O)(=O)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4

Isomeric SMILES

C1=CC2=NSN=C2C(=C1)S(=O)(=O)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4

InChI

InChI=1S/C16H12N6O4S3/c23-28(24,22-16-17-9-2-10-18-16)12-7-5-11(6-8-12)21-29(25,26)14-4-1-3-13-15(14)20-27-19-13/h1-10,21H,(H,17,18,22)