N-isoquinolin-5-yl-4-[[2-oxidanylidene-4-(trifluoromethyl)-1H-quinolin-6-yl]methyl]benzenesulfonamide

Systemtic Name: N-isoquinolin-5-yl-4-[[2-oxidanylidene-4-(trifluoromethyl)-1H-quinolin-6-yl]methyl]benzenesulfonamide Openeye Name: N-(5-isoquinolyl)-4-[[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]methyl]benzenesulfonamide CAS Name: N-(5-isoquinolinyl)-4-[[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]methyl]benzenesulfonamide IUPAC Name: N-isoquinolin-5-yl-4-[[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]methyl]benzenesulfonamide Traditional Name: N-(5-isoquinolyl)-4-[[2-keto-4-(trifluoromethyl)-1H-quinolin-6-yl]methyl]benzenesulfonamide Formula: C26H18F3N3O3S MolecularWeight: 509.49963

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2)C(=C1)NS(=O)(=O)C3=CC=C(C=C3)CC4=CC5=C(C=C4)NC(=O)C=C5C(F)(F)F

Isomeric SMILES

C1=CC2=C(C=CN=C2)C(=C1)NS(=O)(=O)C3=CC=C(C=C3)CC4=CC5=C(C=C4)NC(=O)C=C5C(F)(F)F

InChI

InChI=1S/C26H18F3N3O3S/c27-26(28,29)22-14-25(33)31-23-9-6-17(13-21(22)23)12-16-4-7-19(8-5-16)36(34,35)32-24-3-1-2-18-15-30-11-10-20(18)24/h1-11,13-15,32H,12H2,(H,31,33)