2-[(4-oxidanylidene-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]-N-(3-sulfamoylphenyl)ethanamide

Systemtic Name: 2-[(4-oxidanylidene-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]-N-(3-sulfamoylphenyl)ethanamide Openeye Name: 2-[(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]-N-(3-sulfamoylphenyl)acetamide CAS Name: 2-[(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)thio]-N-(3-sulfamoylphenyl)acetamide IUPAC Name: 2-[(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]-N-(3-sulfamoylphenyl)acetamide Traditional Name: 2-[(4-keto-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)thio]-N-(3-sulfamoylphenyl)acetamide Formula: C19H16N6O4S2 MolecularWeight: 456.49814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=NC(=NC(=O)C3=CN2)SCC(=O)NC4=CC(=CC=C4)S(=O)(=O)N

Isomeric SMILES

C1=CC=C(C=C1)N2C3=NC(=NC(=O)C3=CN2)SCC(=O)NC4=CC(=CC=C4)S(=O)(=O)N

InChI

InChI=1S/C19H16N6O4S2/c20-31(28,29)14-8-4-5-12(9-14)22-16(26)11-30-19-23-17-15(18(27)24-19)10-21-25(17)13-6-2-1-3-7-13/h1-10,21H,11H2,(H,22,26)(H2,20,28,29)