4-[(6-bromanyl-3-ethanoyl-1-oxidanylidene-4-phenyl-isoquinolin-2-yl)methyl]benzenesulfonamide

Systemtic Name: 4-[(6-bromanyl-3-ethanoyl-1-oxidanylidene-4-phenyl-isoquinolin-2-yl)methyl]benzenesulfonamide Openeye Name: 4-[(3-acetyl-6-bromo-1-oxo-4-phenyl-2-isoquinolyl)methyl]benzenesulfonamide CAS Name: 4-[(3-acetyl-6-bromo-1-oxo-4-phenyl-2-isoquinolinyl)methyl]benzenesulfonamide IUPAC Name: 4-[(3-acetyl-6-bromo-1-oxo-4-phenylisoquinolin-2-yl)methyl]benzenesulfonamide Traditional Name: 4-[(3-acetyl-6-bromo-1-keto-4-phenyl-2-isoquinolyl)methyl]benzenesulfonamide Formula: C24H19BrN2O4S MolecularWeight: 511.38766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C2=C(C=CC(=C2)Br)C(=O)N1CC3=CC=C(C=C3)S(=O)(=O)N)C4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=C(C2=C(C=CC(=C2)Br)C(=O)N1CC3=CC=C(C=C3)S(=O)(=O)N)C4=CC=CC=C4

InChI

InChI=1S/C24H19BrN2O4S/c1-15(28)23-22(17-5-3-2-4-6-17)21-13-18(25)9-12-20(21)24(29)27(23)14-16-7-10-19(11-8-16)32(26,30)31/h2-13H,14H2,1H3,(H2,26,30,31)