N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-1-propan-2-yl-6-thiophen-2-yl-pyrazolo[3,4-b]pyridine-4-carboxamide

Systemtic Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-1-propan-2-yl-6-thiophen-2-yl-pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-1-isopropyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: N-[2-(4-ethyl-1-piperazin-4-iumyl)phenyl]-1-propan-2-yl-6-thiophen-2-yl-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-1-propan-2-yl-6-thiophen-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-1-isopropyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C26H31N6OS+ MolecularWeight: 475.62894

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)C3=CC(=NC4=C3C=NN4C(C)C)C5=CC=CS5

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)C3=CC(=NC4=C3C=NN4C(C)C)C5=CC=CS5

InChI

InChI=1S/C26H30N6OS/c1-4-30-11-13-31(14-12-30)23-9-6-5-8-21(23)29-26(33)19-16-22(24-10-7-15-34-24)28-25-20(19)17-27-32(25)18(2)3/h5-10,15-18H,4,11-14H2,1-3H3,(H,29,33)/p+1