4-tert-butyl-N-[4-chloranyl-2-(2H-pyrazolo[3,4-b]pyridin-3-yl)phenyl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[4-chloranyl-2-(2H-pyrazolo[3,4-b]pyridin-3-yl)phenyl]benzenesulfonamide Openeye Name: 4-tert-butyl-N-[4-chloro-2-(2H-pyrazolo[3,4-b]pyridin-3-yl)phenyl]benzenesulfonamide CAS Name: 4-tert-butyl-N-[4-chloro-2-(2H-pyrazolo[3,4-b]pyridin-3-yl)phenyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[4-chloro-2-(2H-pyrazolo[3,4-b]pyridin-3-yl)phenyl]benzenesulfonamide Traditional Name: 4-tert-butyl-N-[4-chloro-2-(2H-pyrazolo[3,4-b]pyridin-3-yl)phenyl]benzenesulfonamide Formula: C22H21ClN4O2S MolecularWeight: 440.94574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)Cl)C3=C4C=CC=NC4=NN3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)Cl)C3=C4C=CC=NC4=NN3

InChI

InChI=1S/C22H21ClN4O2S/c1-22(2,3)14-6-9-16(10-7-14)30(28,29)27-19-11-8-15(23)13-18(19)20-17-5-4-12-24-21(17)26-25-20/h4-13,27H,1-3H3,(H,24,25,26)