4-chloranyl-N-[1-(2-methylpropyl)pyrazolo[3,4-b]quinolin-3-yl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[1-(2-methylpropyl)pyrazolo[3,4-b]quinolin-3-yl]benzenesulfonamide Openeye Name: 4-chloro-N-(1-isobutylpyrazolo[3,4-b]quinolin-3-yl)benzenesulfonamide CAS Name: 4-chloro-N-[1-(2-methylpropyl)-3-pyrazolo[3,4-b]quinolinyl]benzenesulfonamide IUPAC Name: 4-chloro-N-[1-(2-methylpropyl)pyrazolo[3,4-b]quinolin-3-yl]benzenesulfonamide Traditional Name: 4-chloro-N-(1-isobutylpyrazolo[3,4-b]quinolin-3-yl)benzenesulfonamide Formula: C20H19ClN4O2S MolecularWeight: 414.90846

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=NC3=CC=CC=C3C=C2C(=N1)NS(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C)CN1C2=NC3=CC=CC=C3C=C2C(=N1)NS(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H19ClN4O2S/c1-13(2)12-25-20-17(11-14-5-3-4-6-18(14)22-20)19(23-25)24-28(26,27)16-9-7-15(21)8-10-16/h3-11,13H,12H2,1-2H3,(H,23,24)