N-[(4-fluoranyl-2-methylsulfonyl-phenyl)methyl]-5-(1-methyl-5-oxidanylidene-pyrrolidin-3-yl)-8-oxidanyl-1,6-naphthyridine-7-carboxamide

Systemtic Name: N-[(4-fluoranyl-2-methylsulfonyl-phenyl)methyl]-5-(1-methyl-5-oxidanylidene-pyrrolidin-3-yl)-8-oxidanyl-1,6-naphthyridine-7-carboxamide Openeye Name: N-[(4-fluoro-2-methylsulfonyl-phenyl)methyl]-8-hydroxy-5-(1-methyl-5-oxo-pyrrolidin-3-yl)-1,6-naphthyridine-7-carboxamide CAS Name: N-[(4-fluoro-2-methylsulfonylphenyl)methyl]-8-hydroxy-5-(1-methyl-5-oxo-3-pyrrolidinyl)-1,6-naphthyridine-7-carboxamide IUPAC Name: N-[(4-fluoro-2-methylsulfonylphenyl)methyl]-8-hydroxy-5-(1-methyl-5-oxopyrrolidin-3-yl)-1,6-naphthyridine-7-carboxamide Traditional Name: N-(4-fluoro-2-mesyl-benzyl)-8-hydroxy-5-(5-keto-1-methyl-pyrrolidin-3-yl)-1,6-naphthyridine-7-carboxamide Formula: C22H21FN4O5S MolecularWeight: 472.489343

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(CC1=O)C2=NC(=C(C3=C2C=CC=N3)O)C(=O)NCC4=C(C=C(C=C4)F)S(=O)(=O)C

Isomeric SMILES

CN1CC(CC1=O)C2=NC(=C(C3=C2C=CC=N3)O)C(=O)NCC4=C(C=C(C=C4)F)S(=O)(=O)C

InChI

InChI=1S/C22H21FN4O5S/c1-27-11-13(8-17(27)28)18-15-4-3-7-24-19(15)21(29)20(26-18)22(30)25-10-12-5-6-14(23)9-16(12)33(2,31)32/h3-7,9,13,29H,8,10-11H2,1-2H3,(H,25,30)