N-[1-(4-tert-butylphenyl)cycloheptyl]-1-ethyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: N-[1-(4-tert-butylphenyl)cycloheptyl]-1-ethyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: N-[1-(4-tert-butylphenyl)cycloheptyl]-1-ethyl-4-(tetrahydropyran-4-ylamino)pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: N-[1-(4-tert-butylphenyl)cycloheptyl]-1-ethyl-4-(4-oxanylamino)-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-[1-(4-tert-butylphenyl)cycloheptyl]-1-ethyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: N-[1-(4-tert-butylphenyl)cycloheptyl]-1-ethyl-4-(tetrahydropyran-4-ylamino)pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C31H43N5O2 MolecularWeight: 517.70542

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=NC=C(C(=C2C=N1)NC3CCOCC3)C(=O)NC4(CCCCCC4)C5=CC=C(C=C5)C(C)(C)C

Isomeric SMILES

CCN1C2=NC=C(C(=C2C=N1)NC3CCOCC3)C(=O)NC4(CCCCCC4)C5=CC=C(C=C5)C(C)(C)C

InChI

InChI=1S/C31H43N5O2/c1-5-36-28-25(21-33-36)27(34-24-14-18-38-19-15-24)26(20-32-28)29(37)35-31(16-8-6-7-9-17-31)23-12-10-22(11-13-23)30(2,3)4/h10-13,20-21,24H,5-9,14-19H2,1-4H3,(H,32,34)(H,35,37)