6-cyclobutyl-N-[(3,4-dimethylphenyl)methyl]-1-ethyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: 6-cyclobutyl-N-[(3,4-dimethylphenyl)methyl]-1-ethyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: 6-cyclobutyl-N-[(3,4-dimethylphenyl)methyl]-1-ethyl-4-(tetrahydropyran-4-ylamino)pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: 6-cyclobutyl-N-[(3,4-dimethylphenyl)methyl]-1-ethyl-4-(4-oxanylamino)-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 6-cyclobutyl-N-[(3,4-dimethylphenyl)methyl]-1-ethyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: 6-cyclobutyl-N-(3,4-dimethylbenzyl)-1-ethyl-4-(tetrahydropyran-4-ylamino)pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C27H35N5O2 MolecularWeight: 461.5991

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=NC(=C(C(=C2C=N1)NC3CCOCC3)C(=O)NCC4=CC(=C(C=C4)C)C)C5CCC5

Isomeric SMILES

CCN1C2=NC(=C(C(=C2C=N1)NC3CCOCC3)C(=O)NCC4=CC(=C(C=C4)C)C)C5CCC5

InChI

InChI=1S/C27H35N5O2/c1-4-32-26-22(16-29-32)25(30-21-10-12-34-13-11-21)23(24(31-26)20-6-5-7-20)27(33)28-15-19-9-8-17(2)18(3)14-19/h8-9,14,16,20-21H,4-7,10-13,15H2,1-3H3,(H,28,33)(H,30,31)