1,3-dimethyl-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxamide

Systemtic Name: 1,3-dimethyl-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: 1,3-dimethyl-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: 1,3-dimethyl-N-[4-(4-methyl-1-piperazin-4-iumyl)phenyl]-6-phenyl-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 1,3-dimethyl-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-6-phenylpyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: 1,3-dimethyl-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C26H29N6O+ MolecularWeight: 441.54806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)N5CC[NH+](CC5)C)C

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)N5CC[NH+](CC5)C)C

InChI

InChI=1S/C26H28N6O/c1-18-24-22(17-23(19-7-5-4-6-8-19)28-25(24)31(3)29-18)26(33)27-20-9-11-21(12-10-20)32-15-13-30(2)14-16-32/h4-12,17H,13-16H2,1-3H3,(H,27,33)/p+1