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

Systemtic Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)phenyl]-3-fluoranyl-4-methyl-benzenesulfonamide Openeye Name: N-[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]-3-fluoro-4-methyl-benzenesulfonamide CAS Name: N-[3-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]phenyl]-3-fluoro-4-methylbenzenesulfonamide IUPAC Name: N-[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]-3-fluoro-4-methylbenzenesulfonamide Traditional Name: N-[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]-3-fluoro-4-methyl-benzenesulfonamide Formula: C23H21FN2O3S MolecularWeight: 424.487843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)N3CCC4=CC=CC=C4C3)F

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)N3CCC4=CC=CC=C4C3)F

InChI

InChI=1S/C23H21FN2O3S/c1-16-9-10-21(14-22(16)24)30(28,29)25-20-8-4-7-18(13-20)23(27)26-12-11-17-5-2-3-6-19(17)15-26/h2-10,13-14,25H,11-12,15H2,1H3