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

Systemtic Name: 4-[4-oxidanylidene-6-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-2H-pyrazolo[3,4-d]pyrimidin-1-yl]benzenesulfonamide Openeye Name: 4-[4-oxo-6-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-2H-pyrazolo[3,4-d]pyrimidin-1-yl]benzenesulfonamide CAS Name: 4-[4-oxo-6-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-2H-pyrazolo[3,4-d]pyrimidin-1-yl]benzenesulfonamide IUPAC Name: 4-[4-oxo-6-(2-oxo-2-piperidin-1-ylethyl)sulfanyl-2H-pyrazolo[3,4-d]pyrimidin-1-yl]benzenesulfonamide Traditional Name: 4-[4-keto-6-[(2-keto-2-piperidino-ethyl)thio]-2H-pyrazolo[3,4-d]pyrimidin-1-yl]benzenesulfonamide Formula: C18H20N6O4S2 MolecularWeight: 448.5192

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CSC2=NC(=O)C3=CNN(C3=N2)C4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

C1CCN(CC1)C(=O)CSC2=NC(=O)C3=CNN(C3=N2)C4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C18H20N6O4S2/c19-30(27,28)13-6-4-12(5-7-13)24-16-14(10-20-24)17(26)22-18(21-16)29-11-15(25)23-8-2-1-3-9-23/h4-7,10,20H,1-3,8-9,11H2,(H2,19,27,28)