4-[(4-aminocarbonylcyclohexyl)amino]-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-1-ethyl-pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: 4-[(4-aminocarbonylcyclohexyl)amino]-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-1-ethyl-pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: 4-[(4-carbamoylcyclohexyl)amino]-N-(2,3-dihydrobenzofuran-5-ylmethyl)-1-ethyl-pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: 4-[(4-carbamoylcyclohexyl)amino]-N-(2,3-dihydrobenzofuran-5-ylmethyl)-1-ethyl-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 4-[(4-carbamoylcyclohexyl)amino]-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-1-ethylpyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: 4-[(4-carbamoylcyclohexyl)amino]-N-(coumaran-5-ylmethyl)-1-ethyl-pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C25H30N6O3 MolecularWeight: 462.5441

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=NC=C(C(=C2C=N1)NC3CCC(CC3)C(=O)N)C(=O)NCC4=CC5=C(C=C4)OCC5

Isomeric SMILES

CCN1C2=NC=C(C(=C2C=N1)NC3CCC(CC3)C(=O)N)C(=O)NCC4=CC5=C(C=C4)OCC5

InChI

InChI=1S/C25H30N6O3/c1-2-31-24-19(14-29-31)22(30-18-6-4-16(5-7-18)23(26)32)20(13-27-24)25(33)28-12-15-3-8-21-17(11-15)9-10-34-21/h3,8,11,13-14,16,18H,2,4-7,9-10,12H2,1H3,(H2,26,32)(H,27,30)(H,28,33)