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

Systemtic Name: N-[5-chloranyl-2-(4-methylpiperazin-1-yl)phenyl]-1-propan-2-yl-6-thiophen-2-yl-pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: N-[5-chloro-2-(4-methylpiperazin-1-yl)phenyl]-1-isopropyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: N-[5-chloro-2-(4-methyl-1-piperazinyl)phenyl]-1-propan-2-yl-6-thiophen-2-yl-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-[5-chloro-2-(4-methylpiperazin-1-yl)phenyl]-1-propan-2-yl-6-thiophen-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: N-[5-chloro-2-(4-methylpiperazino)phenyl]-1-isopropyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C25H27ClN6OS MolecularWeight: 495.03948

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C=N1)C(=CC(=N2)C3=CC=CS3)C(=O)NC4=C(C=CC(=C4)Cl)N5CCN(CC5)C

Isomeric SMILES

CC(C)N1C2=C(C=N1)C(=CC(=N2)C3=CC=CS3)C(=O)NC4=C(C=CC(=C4)Cl)N5CCN(CC5)C

InChI

InChI=1S/C25H27ClN6OS/c1-16(2)32-24-19(15-27-32)18(14-21(28-24)23-5-4-12-34-23)25(33)29-20-13-17(26)6-7-22(20)31-10-8-30(3)9-11-31/h4-7,12-16H,8-11H2,1-3H3,(H,29,33)