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

Systemtic Name: 4-[6-[2-(2-ethylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-1-yl]benzenesulfonamide Openeye Name: 4-[6-[2-(2-ethyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl]benzenesulfonamide CAS Name: 4-[6-[[2-(2-ethyl-1-piperidinyl)-2-oxoethyl]thio]-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl]benzenesulfonamide IUPAC Name: 4-[6-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]sulfanyl-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl]benzenesulfonamide Traditional Name: 4-[6-[[2-(2-ethylpiperidino)-2-keto-ethyl]thio]-4-keto-2H-pyrazolo[3,4-d]pyrimidin-1-yl]benzenesulfonamide Formula: C20H24N6O4S2 MolecularWeight: 476.57236

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)CSC2=NC(=O)C3=CNN(C3=N2)C4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

CCC1CCCCN1C(=O)CSC2=NC(=O)C3=CNN(C3=N2)C4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C20H24N6O4S2/c1-2-13-5-3-4-10-25(13)17(27)12-31-20-23-18-16(19(28)24-20)11-22-26(18)14-6-8-15(9-7-14)32(21,29)30/h6-9,11,13,22H,2-5,10,12H2,1H3,(H2,21,29,30)