N-[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[4-[(2,6-dimethyl-4-pyrimidinyl)sulfamoyl]phenyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl]piazthiole-4-sulfonamide Formula: C18H16N6O4S3 MolecularWeight: 476.55244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C)NS(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

CC1=CC(=NC(=N1)C)NS(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C18H16N6O4S3/c1-11-10-17(20-12(2)19-11)24-30(25,26)14-8-6-13(7-9-14)23-31(27,28)16-5-3-4-15-18(16)22-29-21-15/h3-10,23H,1-2H3,(H,19,20,24)