5-fluoranyl-2-(1H-pyrrolo[2,3-b]pyridin-4-ylmethylamino)-N-[2-(trifluoromethyl)-3H-benzimidazol-5-yl]pyridine-3-carboxamide

Systemtic Name: 5-fluoranyl-2-(1H-pyrrolo[2,3-b]pyridin-4-ylmethylamino)-N-[2-(trifluoromethyl)-3H-benzimidazol-5-yl]pyridine-3-carboxamide Openeye Name: 5-fluoro-2-(1H-pyrrolo[2,3-b]pyridin-4-ylmethylamino)-N-[2-(trifluoromethyl)-3H-benzimidazol-5-yl]pyridine-3-carboxamide CAS Name: 5-fluoro-2-(1H-pyrrolo[2,3-b]pyridin-4-ylmethylamino)-N-[2-(trifluoromethyl)-3H-benzimidazol-5-yl]-3-pyridinecarboxamide IUPAC Name: 5-fluoro-2-(1H-pyrrolo[2,3-b]pyridin-4-ylmethylamino)-N-[2-(trifluoromethyl)-3H-benzimidazol-5-yl]pyridine-3-carboxamide Traditional Name: 5-fluoro-2-(1H-pyrrolo[2,3-b]pyridin-4-ylmethylamino)-N-[2-(trifluoromethyl)-3H-benzimidazol-5-yl]nicotinamide Formula: C22H15F4N7O MolecularWeight: 469.394413

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1NC(=O)C3=CC(=CN=C3NCC4=C5C=CNC5=NC=C4)F)NC(=N2)C(F)(F)F

Isomeric SMILES

C1=CC2=C(C=C1NC(=O)C3=CC(=CN=C3NCC4=C5C=CNC5=NC=C4)F)NC(=N2)C(F)(F)F

InChI

InChI=1S/C22H15F4N7O/c23-12-7-15(19(30-10-12)29-9-11-3-5-27-18-14(11)4-6-28-18)20(34)31-13-1-2-16-17(8-13)33-21(32-16)22(24,25)26/h1-8,10H,9H2,(H,27,28)(H,29,30)(H,31,34)(H,32,33)