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

Systemtic Name: N-[(3,4-dimethylphenyl)methyl]-1-ethyl-4-(oxan-4-ylamino)-6-propyl-pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: N-[(3,4-dimethylphenyl)methyl]-1-ethyl-6-propyl-4-(tetrahydropyran-4-ylamino)pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: N-[(3,4-dimethylphenyl)methyl]-1-ethyl-4-(4-oxanylamino)-6-propyl-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-[(3,4-dimethylphenyl)methyl]-1-ethyl-4-(oxan-4-ylamino)-6-propylpyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: N-(3,4-dimethylbenzyl)-1-ethyl-6-propyl-4-(tetrahydropyran-4-ylamino)pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C26H35N5O2 MolecularWeight: 449.5884

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C2C=NN(C2=N1)CC)NC3CCOCC3)C(=O)NCC4=CC(=C(C=C4)C)C

Isomeric SMILES

CCCC1=C(C(=C2C=NN(C2=N1)CC)NC3CCOCC3)C(=O)NCC4=CC(=C(C=C4)C)C

InChI

InChI=1S/C26H35N5O2/c1-5-7-22-23(26(32)27-15-19-9-8-17(3)18(4)14-19)24(29-20-10-12-33-13-11-20)21-16-28-31(6-2)25(21)30-22/h8-9,14,16,20H,5-7,10-13,15H2,1-4H3,(H,27,32)(H,29,30)