N-[2-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)phenyl]-2,3,5,6-tetramethyl-benzenesulfonamide

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)phenyl]-2,3,5,6-tetramethyl-benzenesulfonamide Openeye Name: N-[2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]-2,3,5,6-tetramethyl-benzenesulfonamide CAS Name: N-[2-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]phenyl]-2,3,5,6-tetramethylbenzenesulfonamide IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]-2,3,5,6-tetramethylbenzenesulfonamide Traditional Name: N-[2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]-2,3,5,6-tetramethyl-benzenesulfonamide Formula: C26H28N2O3S MolecularWeight: 448.57712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)NC2=CC=CC=C2C(=O)N3CCC4=CC=CC=C4C3)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)NC2=CC=CC=C2C(=O)N3CCC4=CC=CC=C4C3)C)C

InChI

InChI=1S/C26H28N2O3S/c1-17-15-18(2)20(4)25(19(17)3)32(30,31)27-24-12-8-7-11-23(24)26(29)28-14-13-21-9-5-6-10-22(21)16-28/h5-12,15,27H,13-14,16H2,1-4H3