4-bromanyl-N-[3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)phenyl]benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)phenyl]benzenesulfonamide Openeye Name: 4-bromo-N-[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]benzenesulfonamide CAS Name: 4-bromo-N-[3-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]phenyl]benzenesulfonamide IUPAC Name: 4-bromo-N-[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]benzenesulfonamide Traditional Name: 4-bromo-N-[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]benzenesulfonamide Formula: C22H19BrN2O3S MolecularWeight: 471.36686

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C3=CC(=CC=C3)NS(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)C3=CC(=CC=C3)NS(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H19BrN2O3S/c23-19-8-10-21(11-9-19)29(27,28)24-20-7-3-6-17(14-20)22(26)25-13-12-16-4-1-2-5-18(16)15-25/h1-11,14,24H,12-13,15H2