5-fluoranyl-N-(2-methyl-1,3-benzothiazol-5-yl)-2-(1H-pyrazolo[3,4-b]pyridin-4-ylmethylamino)pyridine-3-carboxamide

Systemtic Name: 5-fluoranyl-N-(2-methyl-1,3-benzothiazol-5-yl)-2-(1H-pyrazolo[3,4-b]pyridin-4-ylmethylamino)pyridine-3-carboxamide Openeye Name: 5-fluoro-N-(2-methyl-1,3-benzothiazol-5-yl)-2-(1H-pyrazolo[3,4-b]pyridin-4-ylmethylamino)pyridine-3-carboxamide CAS Name: 5-fluoro-N-(2-methyl-1,3-benzothiazol-5-yl)-2-(1H-pyrazolo[3,4-b]pyridin-4-ylmethylamino)-3-pyridinecarboxamide IUPAC Name: 5-fluoro-N-(2-methyl-1,3-benzothiazol-5-yl)-2-(1H-pyrazolo[3,4-b]pyridin-4-ylmethylamino)pyridine-3-carboxamide Traditional Name: 5-fluoro-N-(2-methyl-1,3-benzothiazol-5-yl)-2-(1H-pyrazolo[3,4-b]pyridin-4-ylmethylamino)nicotinamide Formula: C21H16FN7OS MolecularWeight: 433.461443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=CC(=C2)NC(=O)C3=CC(=CN=C3NCC4=C5C=NNC5=NC=C4)F

Isomeric SMILES

CC1=NC2=C(S1)C=CC(=C2)NC(=O)C3=CC(=CN=C3NCC4=C5C=NNC5=NC=C4)F

InChI

InChI=1S/C21H16FN7OS/c1-11-27-17-7-14(2-3-18(17)31-11)28-21(30)15-6-13(22)9-25-19(15)24-8-12-4-5-23-20-16(12)10-26-29-20/h2-7,9-10H,8H2,1H3,(H,24,25)(H,28,30)(H,23,26,29)