4-tert-butyl-N-[2-(4-morpholin-4-ylpyrazolo[3,4-d]pyrimidin-1-yl)ethyl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[2-(4-morpholin-4-ylpyrazolo[3,4-d]pyrimidin-1-yl)ethyl]benzenesulfonamide Openeye Name: 4-tert-butyl-N-[2-(4-morpholinopyrazolo[3,4-d]pyrimidin-1-yl)ethyl]benzenesulfonamide CAS Name: 4-tert-butyl-N-[2-[4-(4-morpholinyl)-1-pyrazolo[3,4-d]pyrimidinyl]ethyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[2-(4-morpholin-4-ylpyrazolo[3,4-d]pyrimidin-1-yl)ethyl]benzenesulfonamide Traditional Name: 4-tert-butyl-N-[2-(4-morpholinopyrazolo[3,4-d]pyrimidin-1-yl)ethyl]benzenesulfonamide Formula: C21H28N6O3S MolecularWeight: 444.55042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NCCN2C3=C(C=N2)C(=NC=N3)N4CCOCC4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NCCN2C3=C(C=N2)C(=NC=N3)N4CCOCC4

InChI

InChI=1S/C21H28N6O3S/c1-21(2,3)16-4-6-17(7-5-16)31(28,29)25-8-9-27-20-18(14-24-27)19(22-15-23-20)26-10-12-30-13-11-26/h4-7,14-15,25H,8-13H2,1-3H3