4-butoxy-N-isoquinolin-5-yl-benzenesulfonamide

Systemtic Name: 4-butoxy-N-isoquinolin-5-yl-benzenesulfonamide Openeye Name: 4-butoxy-N-(5-isoquinolyl)benzenesulfonamide CAS Name: 4-butoxy-N-(5-isoquinolinyl)benzenesulfonamide IUPAC Name: 4-butoxy-N-isoquinolin-5-ylbenzenesulfonamide Traditional Name: 4-butoxy-N-(5-isoquinolyl)benzenesulfonamide Formula: C19H20N2O3S MolecularWeight: 356.4387

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC3=C2C=CN=C3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C19H20N2O3S/c1-2-3-13-24-16-7-9-17(10-8-16)25(22,23)21-19-6-4-5-15-14-20-12-11-18(15)19/h4-12,14,21H,2-3,13H2,1H3