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

Systemtic Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]-6-phenyl-1-propan-2-yl-pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]-1-isopropyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: N-[4-(4-ethyl-1-piperazin-4-iumyl)-2-methylphenyl]-6-phenyl-1-propan-2-yl-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methylphenyl]-6-phenyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]-1-isopropyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C29H35N6O+ MolecularWeight: 483.6278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H34N6O/c1-5-33-13-15-34(16-14-33)23-11-12-26(21(4)17-23)32-29(36)24-18-27(22-9-7-6-8-10-22)31-28-25(24)19-30-35(28)20(2)3/h6-12,17-20H,5,13-16H2,1-4H3,(H,32,36)/p+1