1-(4-fluorophenyl)-N-[(2-methylsulfonyl-1-oxidanidyl-pyridin-1-ium-4-yl)methyl]pyrazolo[3,4-c]pyridine-4-carboxamide

Systemtic Name: 1-(4-fluorophenyl)-N-[(2-methylsulfonyl-1-oxidanidyl-pyridin-1-ium-4-yl)methyl]pyrazolo[3,4-c]pyridine-4-carboxamide Openeye Name: 1-(4-fluorophenyl)-N-[(2-methylsulfonyl-1-oxido-pyridin-1-ium-4-yl)methyl]pyrazolo[3,4-c]pyridine-4-carboxamide CAS Name: 1-(4-fluorophenyl)-N-[(2-methylsulfonyl-1-oxido-4-pyridin-1-iumyl)methyl]-4-pyrazolo[3,4-c]pyridinecarboxamide IUPAC Name: 1-(4-fluorophenyl)-N-[(2-methylsulfonyl-1-oxidopyridin-1-ium-4-yl)methyl]pyrazolo[3,4-c]pyridine-4-carboxamide Traditional Name: 1-(4-fluorophenyl)-N-[(2-mesyl-1-oxido-pyridin-1-ium-4-yl)methyl]pyrazolo[3,4-c]pyridine-4-carboxamide Formula: C20H16FN5O4S MolecularWeight: 441.435543

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=[N+](C=CC(=C1)CNC(=O)C2=CN=CC3=C2C=NN3C4=CC=C(C=C4)F)[O-]

Isomeric SMILES

CS(=O)(=O)C1=[N+](C=CC(=C1)CNC(=O)C2=CN=CC3=C2C=NN3C4=CC=C(C=C4)F)[O-]

InChI

InChI=1S/C20H16FN5O4S/c1-31(29,30)19-8-13(6-7-25(19)28)9-23-20(27)17-10-22-12-18-16(17)11-24-26(18)15-4-2-14(21)3-5-15/h2-8,10-12H,9H2,1H3,(H,23,27)