N-[5-chloranyl-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-6-methyl-1-propan-2-yl-pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: N-[5-chloranyl-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-6-methyl-1-propan-2-yl-pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: N-[5-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-1-isopropyl-6-methyl-pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: N-[5-chloro-2-(4-ethyl-1-piperazin-4-iumyl)phenyl]-6-methyl-1-propan-2-yl-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-[5-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-6-methyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: N-[5-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-1-isopropyl-6-methyl-pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C23H30ClN6O+ MolecularWeight: 441.9769

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3=C(N=C4C(=C3)C=NN4C(C)C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3=C(N=C4C(=C3)C=NN4C(C)C)C

InChI

InChI=1S/C23H29ClN6O/c1-5-28-8-10-29(11-9-28)21-7-6-18(24)13-20(21)27-23(31)19-12-17-14-25-30(15(2)3)22(17)26-16(19)4/h6-7,12-15H,5,8-11H2,1-4H3,(H,27,31)/p+1