N-[(4-chloranyl-2-methyl-phenyl)methyl]-6-cyclobutyl-1-ethyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: N-[(4-chloranyl-2-methyl-phenyl)methyl]-6-cyclobutyl-1-ethyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: N-[(4-chloro-2-methyl-phenyl)methyl]-6-cyclobutyl-1-ethyl-4-(tetrahydropyran-4-ylamino)pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: N-[(4-chloro-2-methylphenyl)methyl]-6-cyclobutyl-1-ethyl-4-(4-oxanylamino)-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-[(4-chloro-2-methylphenyl)methyl]-6-cyclobutyl-1-ethyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: N-(4-chloro-2-methyl-benzyl)-6-cyclobutyl-1-ethyl-4-(tetrahydropyran-4-ylamino)pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C26H32ClN5O2 MolecularWeight: 482.01758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H32ClN5O2/c1-3-32-25-21(15-29-32)24(30-20-9-11-34-12-10-20)22(23(31-25)17-5-4-6-17)26(33)28-14-18-7-8-19(27)13-16(18)2/h7-8,13,15,17,20H,3-6,9-12,14H2,1-2H3,(H,28,33)(H,30,31)