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

Systemtic Name: azocan-1-yl-(1-pyridin-2-yl-4-thiophen-2-yl-pyrazolo[3,4-b]pyridin-3-yl)methanone Openeye Name: azocan-1-yl-[1-(2-pyridyl)-4-(2-thienyl)pyrazolo[3,4-b]pyridin-3-yl]methanone CAS Name: 1-azocanyl-[1-(2-pyridinyl)-4-thiophen-2-yl-3-pyrazolo[3,4-b]pyridinyl]methanone IUPAC Name: azocan-1-yl-(1-pyridin-2-yl-4-thiophen-2-ylpyrazolo[3,4-b]pyridin-3-yl)methanone Traditional Name: azocan-1-yl-[1-(2-pyridyl)-4-(2-thienyl)pyrazolo[3,4-b]pyridin-3-yl]methanone Formula: C23H23N5OS MolecularWeight: 417.52662

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)C(=O)C2=NN(C3=NC=CC(=C23)C4=CC=CS4)C5=CC=CC=N5

Isomeric SMILES

C1CCCN(CCC1)C(=O)C2=NN(C3=NC=CC(=C23)C4=CC=CS4)C5=CC=CC=N5

InChI

InChI=1S/C23H23N5OS/c29-23(27-14-6-2-1-3-7-15-27)21-20-17(18-9-8-16-30-18)11-13-25-22(20)28(26-21)19-10-4-5-12-24-19/h4-5,8-13,16H,1-3,6-7,14-15H2