4-bromanyl-N-[3-(7-chloranyl-3,4-dihydroisoquinolin-1-yl)phenyl]benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[3-(7-chloranyl-3,4-dihydroisoquinolin-1-yl)phenyl]benzenesulfonamide Openeye Name: 4-bromo-N-[3-(7-chloro-3,4-dihydroisoquinolin-1-yl)phenyl]benzenesulfonamide CAS Name: 4-bromo-N-[3-(7-chloro-3,4-dihydroisoquinolin-1-yl)phenyl]benzenesulfonamide IUPAC Name: 4-bromo-N-[3-(7-chloro-3,4-dihydroisoquinolin-1-yl)phenyl]benzenesulfonamide Traditional Name: 4-bromo-N-[3-(7-chloro-3,4-dihydroisoquinolin-1-yl)phenyl]benzenesulfonamide Formula: C21H16BrClN2O2S MolecularWeight: 475.78594

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(C2=C1C=CC(=C2)Cl)C3=CC(=CC=C3)NS(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CN=C(C2=C1C=CC(=C2)Cl)C3=CC(=CC=C3)NS(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H16BrClN2O2S/c22-16-5-8-19(9-6-16)28(26,27)25-18-3-1-2-15(12-18)21-20-13-17(23)7-4-14(20)10-11-24-21/h1-9,12-13,25H,10-11H2