4-bromanyl-N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)benzenesulfonamide

Systemtic Name: 4-bromanyl-N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)benzenesulfonamide Openeye Name: 4-bromo-N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)benzenesulfonamide CAS Name: 4-bromo-N-(1-butyl-3-pyrazolo[3,4-b]quinolinyl)benzenesulfonamide IUPAC Name: 4-bromo-N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)benzenesulfonamide Traditional Name: 4-bromo-N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)benzenesulfonamide Formula: C20H19BrN4O2S MolecularWeight: 459.35946

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=NC3=CC=CC=C3C=C2C(=N1)NS(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CCCCN1C2=NC3=CC=CC=C3C=C2C(=N1)NS(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C20H19BrN4O2S/c1-2-3-12-25-20-17(13-14-6-4-5-7-18(14)22-20)19(23-25)24-28(26,27)16-10-8-15(21)9-11-16/h4-11,13H,2-3,12H2,1H3,(H,23,24)