1-[(2-azanylquinolin-4-yl)methyl]-6-fluoranyl-5-methyl-N-methylsulfonyl-3-(2-oxidanylidene-1H-pyridin-3-yl)pyrrolo[3,2-b]pyridine-2-carboxamide

Systemtic Name: 1-[(2-azanylquinolin-4-yl)methyl]-6-fluoranyl-5-methyl-N-methylsulfonyl-3-(2-oxidanylidene-1H-pyridin-3-yl)pyrrolo[3,2-b]pyridine-2-carboxamide Openeye Name: 1-[(2-amino-4-quinolyl)methyl]-6-fluoro-5-methyl-N-methylsulfonyl-3-(2-oxo-1H-pyridin-3-yl)pyrrolo[3,2-b]pyridine-2-carboxamide CAS Name: 1-[(2-amino-4-quinolinyl)methyl]-6-fluoro-5-methyl-N-methylsulfonyl-3-(2-oxo-1H-pyridin-3-yl)-2-pyrrolo[3,2-b]pyridinecarboxamide IUPAC Name: 1-[(2-aminoquinolin-4-yl)methyl]-6-fluoro-5-methyl-N-methylsulfonyl-3-(2-oxo-1H-pyridin-3-yl)pyrrolo[3,2-b]pyridine-2-carboxamide Traditional Name: 1-[(2-amino-4-quinolyl)methyl]-6-fluoro-3-(2-keto-1H-pyridin-3-yl)-N-mesyl-5-methyl-pyrrolo[3,2-b]pyridine-2-carboxamide Formula: C25H21FN6O4S MolecularWeight: 520.535443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=N1)C(=C(N2CC3=CC(=NC4=CC=CC=C43)N)C(=O)NS(=O)(=O)C)C5=CC=CNC5=O)F

Isomeric SMILES

CC1=C(C=C2C(=N1)C(=C(N2CC3=CC(=NC4=CC=CC=C43)N)C(=O)NS(=O)(=O)C)C5=CC=CNC5=O)F

InChI

InChI=1S/C25H21FN6O4S/c1-13-17(26)11-19-22(29-13)21(16-7-5-9-28-24(16)33)23(25(34)31-37(2,35)36)32(19)12-14-10-20(27)30-18-8-4-3-6-15(14)18/h3-11H,12H2,1-2H3,(H2,27,30)(H,28,33)(H,31,34)