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

Systemtic Name: N-[1-(4-cyclohexyloxy-3-methyl-phenyl)ethyl]-1-ethyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: N-[1-[4-(cyclohexoxy)-3-methyl-phenyl]ethyl]-1-ethyl-4-(tetrahydropyran-4-ylamino)pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: N-[1-(4-cyclohexyloxy-3-methylphenyl)ethyl]-1-ethyl-4-(4-oxanylamino)-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-[1-(4-cyclohexyloxy-3-methylphenyl)ethyl]-1-ethyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: N-[1-[4-(cyclohexoxy)-3-methyl-phenyl]ethyl]-1-ethyl-4-(tetrahydropyran-4-ylamino)pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C29H39N5O3 MolecularWeight: 505.65166

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=NC=C(C(=C2C=N1)NC3CCOCC3)C(=O)NC(C)C4=CC(=C(C=C4)OC5CCCCC5)C

Isomeric SMILES

CCN1C2=NC=C(C(=C2C=N1)NC3CCOCC3)C(=O)NC(C)C4=CC(=C(C=C4)OC5CCCCC5)C

InChI

InChI=1S/C29H39N5O3/c1-4-34-28-24(18-31-34)27(33-22-12-14-36-15-13-22)25(17-30-28)29(35)32-20(3)21-10-11-26(19(2)16-21)37-23-8-6-5-7-9-23/h10-11,16-18,20,22-23H,4-9,12-15H2,1-3H3,(H,30,33)(H,32,35)