N-[(4-aminocarbonylphenyl)methyl]-1-propan-2-yl-6-thiophen-2-yl-pyrazolo[3,4-b]pyridine-4-carboxamide

Systemtic Name: N-[(4-aminocarbonylphenyl)methyl]-1-propan-2-yl-6-thiophen-2-yl-pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: N-[(4-carbamoylphenyl)methyl]-1-isopropyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: N-[(4-carbamoylphenyl)methyl]-1-propan-2-yl-6-thiophen-2-yl-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-[(4-carbamoylphenyl)methyl]-1-propan-2-yl-6-thiophen-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: N-(4-carbamoylbenzyl)-1-isopropyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C22H21N5O2S MolecularWeight: 419.49944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C=N1)C(=CC(=N2)C3=CC=CS3)C(=O)NCC4=CC=C(C=C4)C(=O)N

Isomeric SMILES

CC(C)N1C2=C(C=N1)C(=CC(=N2)C3=CC=CS3)C(=O)NCC4=CC=C(C=C4)C(=O)N

InChI

InChI=1S/C22H21N5O2S/c1-13(2)27-21-17(12-25-27)16(10-18(26-21)19-4-3-9-30-19)22(29)24-11-14-5-7-15(8-6-14)20(23)28/h3-10,12-13H,11H2,1-2H3,(H2,23,28)(H,24,29)