3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-N-(2-fluorophenyl)-4-methyl-benzenesulfonamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC=C2F)C(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC=C2F)C(=O)N3CCC4=CC=CC=C4C3

InChI

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