N-(2,4-dimorpholin-4-ylphenyl)-1-(phenylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: N-(2,4-dimorpholin-4-ylphenyl)-1-(phenylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: 1-benzyl-N-(2,4-dimorpholinophenyl)pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: N-[2,4-bis(4-morpholinyl)phenyl]-1-(phenylmethyl)-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 1-benzyl-N-(2,4-dimorpholin-4-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: 1-benzyl-N-(2,4-dimorpholinophenyl)pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C28H30N6O3 MolecularWeight: 498.5762

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC(=C(C=C2)NC(=O)C3=CN=C4C(=C3)C=NN4CC5=CC=CC=C5)N6CCOCC6

Isomeric SMILES

C1COCCN1C2=CC(=C(C=C2)NC(=O)C3=CN=C4C(=C3)C=NN4CC5=CC=CC=C5)N6CCOCC6

InChI

InChI=1S/C28H30N6O3/c35-28(23-16-22-19-30-34(27(22)29-18-23)20-21-4-2-1-3-5-21)31-25-7-6-24(32-8-12-36-13-9-32)17-26(25)33-10-14-37-15-11-33/h1-7,16-19H,8-15,20H2,(H,31,35)