N-isoquinolin-3-yl-1-methyl-2-oxidanylidene-4-(trifluoromethyl)quinoline-6-sulfonamide

Systemtic Name: N-isoquinolin-3-yl-1-methyl-2-oxidanylidene-4-(trifluoromethyl)quinoline-6-sulfonamide Openeye Name: N-(3-isoquinolyl)-1-methyl-2-oxo-4-(trifluoromethyl)quinoline-6-sulfonamide CAS Name: N-(3-isoquinolinyl)-1-methyl-2-oxo-4-(trifluoromethyl)-6-quinolinesulfonamide IUPAC Name: N-isoquinolin-3-yl-1-methyl-2-oxo-4-(trifluoromethyl)quinoline-6-sulfonamide Traditional Name: N-(3-isoquinolyl)-2-keto-1-methyl-4-(trifluoromethyl)quinoline-6-sulfonamide Formula: C20H14F3N3O3S MolecularWeight: 433.40367

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)NC3=CC4=CC=CC=C4C=N3)C(=CC1=O)C(F)(F)F

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)NC3=CC4=CC=CC=C4C=N3)C(=CC1=O)C(F)(F)F

InChI

InChI=1S/C20H14F3N3O3S/c1-26-17-7-6-14(9-15(17)16(10-19(26)27)20(21,22)23)30(28,29)25-18-8-12-4-2-3-5-13(12)11-24-18/h2-11H,1H3,(H,24,25)