(1-ethyl-6-thiophen-2-yl-pyrazolo[3,4-b]pyridin-4-yl)-(2-pyridin-4-ylpyrrolidin-1-yl)methanone

Systemtic Name: (1-ethyl-6-thiophen-2-yl-pyrazolo[3,4-b]pyridin-4-yl)-(2-pyridin-4-ylpyrrolidin-1-yl)methanone Openeye Name: [1-ethyl-6-(2-thienyl)pyrazolo[3,4-b]pyridin-4-yl]-[2-(4-pyridyl)pyrrolidin-1-yl]methanone CAS Name: (1-ethyl-6-thiophen-2-yl-4-pyrazolo[3,4-b]pyridinyl)-(2-pyridin-4-yl-1-pyrrolidinyl)methanone IUPAC Name: (1-ethyl-6-thiophen-2-ylpyrazolo[3,4-b]pyridin-4-yl)-(2-pyridin-4-ylpyrrolidin-1-yl)methanone Traditional Name: [1-ethyl-6-(2-thienyl)pyrazolo[3,4-b]pyridin-4-yl]-[2-(4-pyridyl)pyrrolidino]methanone Formula: C22H21N5OS MolecularWeight: 403.50004

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=N1)C(=CC(=N2)C3=CC=CS3)C(=O)N4CCCC4C5=CC=NC=C5

Isomeric SMILES

CCN1C2=C(C=N1)C(=CC(=N2)C3=CC=CS3)C(=O)N4CCCC4C5=CC=NC=C5

InChI

InChI=1S/C22H21N5OS/c1-2-27-21-17(14-24-27)16(13-18(25-21)20-6-4-12-29-20)22(28)26-11-3-5-19(26)15-7-9-23-10-8-15/h4,6-10,12-14,19H,2-3,5,11H2,1H3