(3E)-3-[[(4-fluoranyl-2-methylsulfonyl-phenyl)methylamino]-oxidanyl-methylidene]-1H-1,5-naphthyridine-2,4-dione

Systemtic Name: (3E)-3-[[(4-fluoranyl-2-methylsulfonyl-phenyl)methylamino]-oxidanyl-methylidene]-1H-1,5-naphthyridine-2,4-dione Openeye Name: (3E)-3-[[(4-fluoro-2-methylsulfonyl-phenyl)methylamino]-hydroxy-methylene]-1H-1,5-naphthyridine-2,4-dione CAS Name: (3E)-3-[[(4-fluoro-2-methylsulfonylphenyl)methylamino]-hydroxymethylidene]-1H-1,5-naphthyridine-2,4-dione IUPAC Name: (3E)-3-[[(4-fluoro-2-methylsulfonylphenyl)methylamino]-hydroxymethylidene]-1H-1,5-naphthyridine-2,4-dione Traditional Name: (3E)-3-[[(4-fluoro-2-mesyl-benzyl)amino]-hydroxy-methylene]-1H-1,5-naphthyridine-2,4-quinone Formula: C17H14FN3O5S MolecularWeight: 391.373563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1)F)CNC(=C2C(=O)C3=C(C=CC=N3)NC2=O)O

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1)F)CN/C(=C\2/C(=O)C3=C(C=CC=N3)NC2=O)/O

InChI

InChI=1S/C17H14FN3O5S/c1-27(25,26)12-7-10(18)5-4-9(12)8-20-16(23)13-15(22)14-11(21-17(13)24)3-2-6-19-14/h2-7,20,23H,8H2,1H3,(H,21,24)/b16-13+