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

Systemtic Name: 6-cyclobutyl-1-ethyl-4-(oxan-4-ylamino)-N-(phenylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: N-benzyl-6-cyclobutyl-1-ethyl-4-(tetrahydropyran-4-ylamino)pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: 6-cyclobutyl-1-ethyl-4-(4-oxanylamino)-N-(phenylmethyl)-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-benzyl-6-cyclobutyl-1-ethyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: N-benzyl-6-cyclobutyl-1-ethyl-4-(tetrahydropyran-4-ylamino)pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C25H31N5O2 MolecularWeight: 433.54594

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H31N5O2/c1-2-30-24-20(16-27-30)23(28-19-11-13-32-14-12-19)21(22(29-24)18-9-6-10-18)25(31)26-15-17-7-4-3-5-8-17/h3-5,7-8,16,18-19H,2,6,9-15H2,1H3,(H,26,31)(H,28,29)