N-[4-(4-acetamido-2-fluoranyl-phenyl)-1,3-thiazol-2-yl]-6-methyl-1-propan-2-yl-pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: N-[4-(4-acetamido-2-fluoranyl-phenyl)-1,3-thiazol-2-yl]-6-methyl-1-propan-2-yl-pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: N-[4-(4-acetamido-2-fluoro-phenyl)thiazol-2-yl]-1-isopropyl-6-methyl-pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: N-[4-(4-acetamido-2-fluorophenyl)-2-thiazolyl]-6-methyl-1-propan-2-yl-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-[4-(4-acetamido-2-fluorophenyl)-1,3-thiazol-2-yl]-6-methyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: N-[4-(4-acetamido-2-fluoro-phenyl)thiazol-2-yl]-1-isopropyl-6-methyl-pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C22H21FN6O2S MolecularWeight: 452.504543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=NN(C2=N1)C(C)C)C(=O)NC3=NC(=CS3)C4=C(C=C(C=C4)NC(=O)C)F

Isomeric SMILES

CC1=C(C=C2C=NN(C2=N1)C(C)C)C(=O)NC3=NC(=CS3)C4=C(C=C(C=C4)NC(=O)C)F

InChI

InChI=1S/C22H21FN6O2S/c1-11(2)29-20-14(9-24-29)7-17(12(3)25-20)21(31)28-22-27-19(10-32-22)16-6-5-15(8-18(16)23)26-13(4)30/h5-11H,1-4H3,(H,26,30)(H,27,28,31)