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

Systemtic Name: azepan-1-yl-[1-(1-ethyl-6-thiophen-2-yl-pyrazolo[3,4-b]pyridin-4-yl)carbonylpiperidin-4-yl]methanone Openeye Name: azepan-1-yl-[1-[1-ethyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carbonyl]-4-piperidyl]methanone CAS Name: 1-azepanyl-[1-[(1-ethyl-6-thiophen-2-yl-4-pyrazolo[3,4-b]pyridinyl)-oxomethyl]-4-piperidinyl]methanone IUPAC Name: azepan-1-yl-[1-(1-ethyl-6-thiophen-2-ylpyrazolo[3,4-b]pyridine-4-carbonyl)piperidin-4-yl]methanone Traditional Name: azepan-1-yl-[1-[1-ethyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carbonyl]-4-piperidyl]methanone Formula: C25H31N5O2S MolecularWeight: 465.61094

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=N1)C(=CC(=N2)C3=CC=CS3)C(=O)N4CCC(CC4)C(=O)N5CCCCCC5

Isomeric SMILES

CCN1C2=C(C=N1)C(=CC(=N2)C3=CC=CS3)C(=O)N4CCC(CC4)C(=O)N5CCCCCC5

InChI

InChI=1S/C25H31N5O2S/c1-2-30-23-20(17-26-30)19(16-21(27-23)22-8-7-15-33-22)25(32)29-13-9-18(10-14-29)24(31)28-11-5-3-4-6-12-28/h7-8,15-18H,2-6,9-14H2,1H3