2-[2-fluoranyl-4-(2-methylsulfonylphenyl)phenyl]-1,4-dihydroisoquinolin-3-one

Systemtic Name: 2-[2-fluoranyl-4-(2-methylsulfonylphenyl)phenyl]-1,4-dihydroisoquinolin-3-one Openeye Name: 2-[2-fluoro-4-(2-methylsulfonylphenyl)phenyl]-1,4-dihydroisoquinolin-3-one CAS Name: 2-[2-fluoro-4-(2-methylsulfonylphenyl)phenyl]-1,4-dihydroisoquinolin-3-one IUPAC Name: 2-[2-fluoro-4-(2-methylsulfonylphenyl)phenyl]-1,4-dihydroisoquinolin-3-one Traditional Name: 2-[2-fluoro-4-(2-mesylphenyl)phenyl]-1,4-dihydroisoquinolin-3-one Formula: C22H18FNO3S MolecularWeight: 395.446623

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C2=CC(=C(C=C2)N3CC4=CC=CC=C4CC3=O)F

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C2=CC(=C(C=C2)N3CC4=CC=CC=C4CC3=O)F

InChI

InChI=1S/C22H18FNO3S/c1-28(26,27)21-9-5-4-8-18(21)16-10-11-20(19(23)12-16)24-14-17-7-3-2-6-15(17)13-22(24)25/h2-12H,13-14H2,1H3