4-fluoranyl-N-[4-[(7-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylamino]phenyl]benzenesulfonamide

Systemtic Name: 4-fluoranyl-N-[4-[(7-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylamino]phenyl]benzenesulfonamide Openeye Name: 4-fluoro-N-[4-[(7-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylamino]phenyl]benzenesulfonamide CAS Name: 4-fluoro-N-[4-[(7-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylamino]phenyl]benzenesulfonamide IUPAC Name: 4-fluoro-N-[4-[(7-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylamino]phenyl]benzenesulfonamide Traditional Name: 4-fluoro-N-[4-[(4-keto-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylamino]phenyl]benzenesulfonamide Formula: C22H20FN4O3S+ MolecularWeight: 439.482603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+]2=C(C=C1)NC(=CC2=O)CNC3=CC=C(C=C3)NS(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=C[N+]2=C(C=C1)NC(=CC2=O)CNC3=CC=C(C=C3)NS(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H19FN4O3S/c1-15-2-11-21-25-19(12-22(28)27(21)14-15)13-24-17-5-7-18(8-6-17)26-31(29,30)20-9-3-16(23)4-10-20/h2-12,14,24,26H,13H2,1H3/p+1