3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-N-(2-fluorophenyl)-4-oxidanylidene-1H-quinoline-6-sulfonamide

Systemtic Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-N-(2-fluorophenyl)-4-oxidanylidene-1H-quinoline-6-sulfonamide Openeye Name: 3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N-(2-fluorophenyl)-4-oxo-1H-quinoline-6-sulfonamide CAS Name: 3-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-N-(2-fluorophenyl)-4-oxo-1H-quinoline-6-sulfonamide IUPAC Name: 3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N-(2-fluorophenyl)-4-oxo-1H-quinoline-6-sulfonamide Traditional Name: 3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N-(2-fluorophenyl)-4-keto-1H-quinoline-6-sulfonamide Formula: C25H20FN3O4S MolecularWeight: 477.507403

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C3=CNC4=C(C3=O)C=C(C=C4)S(=O)(=O)NC5=CC=CC=C5F

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)C3=CNC4=C(C3=O)C=C(C=C4)S(=O)(=O)NC5=CC=CC=C5F

InChI

InChI=1S/C25H20FN3O4S/c26-21-7-3-4-8-23(21)28-34(32,33)18-9-10-22-19(13-18)24(30)20(14-27-22)25(31)29-12-11-16-5-1-2-6-17(16)15-29/h1-10,13-14,28H,11-12,15H2,(H,27,30)