N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-ethyl-6-thiophen-2-yl-pyrazolo[3,4-b]pyridine-4-carboxamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-ethyl-6-thiophen-2-yl-pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-ethyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-ethyl-6-thiophen-2-yl-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-ethyl-6-thiophen-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: 1-ethyl-N-homopiperonyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C22H20N4O3S MolecularWeight: 420.4842

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=N1)C(=CC(=N2)C3=CC=CS3)C(=O)NCCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCN1C2=C(C=N1)C(=CC(=N2)C3=CC=CS3)C(=O)NCCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H20N4O3S/c1-2-26-21-16(12-24-26)15(11-17(25-21)20-4-3-9-30-20)22(27)23-8-7-14-5-6-18-19(10-14)29-13-28-18/h3-6,9-12H,2,7-8,13H2,1H3,(H,23,27)