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

Systemtic Name: 2-[(4-oxidanylidene-1-pyridin-2-yl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]-N-(4-sulfamoylphenyl)ethanamide Openeye Name: 2-[[4-oxo-1-(2-pyridyl)-2H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl]-N-(4-sulfamoylphenyl)acetamide CAS Name: 2-[[4-oxo-1-(2-pyridinyl)-2H-pyrazolo[3,4-d]pyrimidin-6-yl]thio]-N-(4-sulfamoylphenyl)acetamide IUPAC Name: 2-[(4-oxo-1-pyridin-2-yl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]-N-(4-sulfamoylphenyl)acetamide Traditional Name: 2-[[4-keto-1-(2-pyridyl)-2H-pyrazolo[3,4-d]pyrimidin-6-yl]thio]-N-(4-sulfamoylphenyl)acetamide Formula: C18H15N7O4S2 MolecularWeight: 457.4862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15N7O4S2/c19-31(28,29)12-6-4-11(5-7-12)22-15(26)10-30-18-23-16-13(17(27)24-18)9-21-25(16)14-3-1-2-8-20-14/h1-9,21H,10H2,(H,22,26)(H2,19,28,29)