2-[4-(1-ethyl-6-thiophen-2-yl-pyrazolo[3,4-b]pyridin-4-yl)carbonylpiperazin-1-yl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[4-(1-ethyl-6-thiophen-2-yl-pyrazolo[3,4-b]pyridin-4-yl)carbonylpiperazin-1-yl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[4-[1-ethyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carbonyl]piperazin-1-yl]acetamide CAS Name: 2-[4-[(1-ethyl-6-thiophen-2-yl-4-pyrazolo[3,4-b]pyridinyl)-oxomethyl]-1-piperazinyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4-(1-ethyl-6-thiophen-2-ylpyrazolo[3,4-b]pyridine-4-carbonyl)piperazin-1-yl]acetamide Traditional Name: N-benzyl-2-[4-[1-ethyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carbonyl]piperazino]acetamide Formula: C26H28N6O2S MolecularWeight: 488.60452

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=N1)C(=CC(=N2)C3=CC=CS3)C(=O)N4CCN(CC4)CC(=O)NCC5=CC=CC=C5

Isomeric SMILES

CCN1C2=C(C=N1)C(=CC(=N2)C3=CC=CS3)C(=O)N4CCN(CC4)CC(=O)NCC5=CC=CC=C5

InChI

InChI=1S/C26H28N6O2S/c1-2-32-25-21(17-28-32)20(15-22(29-25)23-9-6-14-35-23)26(34)31-12-10-30(11-13-31)18-24(33)27-16-19-7-4-3-5-8-19/h3-9,14-15,17H,2,10-13,16,18H2,1H3,(H,27,33)