4-(6-methylsulfanyl-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-1-yl)benzenesulfonamide

Systemtic Name: 4-(6-methylsulfanyl-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-1-yl)benzenesulfonamide Openeye Name: 4-(6-methylsulfanyl-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)benzenesulfonamide CAS Name: 4-[6-(methylthio)-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl]benzenesulfonamide IUPAC Name: 4-(6-methylsulfanyl-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)benzenesulfonamide Traditional Name: 4-[4-keto-6-(methylthio)-2H-pyrazolo[3,4-d]pyrimidin-1-yl]benzenesulfonamide Formula: C12H11N5O3S2 MolecularWeight: 337.37744

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=O)C2=CNN(C2=N1)C3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CSC1=NC(=O)C2=CNN(C2=N1)C3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C12H11N5O3S2/c1-21-12-15-10-9(11(18)16-12)6-14-17(10)7-2-4-8(5-3-7)22(13,19)20/h2-6,14H,1H3,(H2,13,19,20)