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

Systemtic Name: N-[5-chloranyl-2-(4-methylpiperazin-1-yl)phenyl]-3-methyl-1-phenyl-6-thiophen-2-yl-pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: N-[5-chloro-2-(4-methylpiperazin-1-yl)phenyl]-3-methyl-1-phenyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: N-[5-chloro-2-(4-methyl-1-piperazinyl)phenyl]-3-methyl-1-phenyl-6-thiophen-2-yl-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-[5-chloro-2-(4-methylpiperazin-1-yl)phenyl]-3-methyl-1-phenyl-6-thiophen-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: N-[5-chloro-2-(4-methylpiperazino)phenyl]-3-methyl-1-phenyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C29H27ClN6OS MolecularWeight: 543.08228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CS3)C(=O)NC4=C(C=CC(=C4)Cl)N5CCN(CC5)C)C6=CC=CC=C6

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CS3)C(=O)NC4=C(C=CC(=C4)Cl)N5CCN(CC5)C)C6=CC=CC=C6

InChI

InChI=1S/C29H27ClN6OS/c1-19-27-22(29(37)32-23-17-20(30)10-11-25(23)35-14-12-34(2)13-15-35)18-24(26-9-6-16-38-26)31-28(27)36(33-19)21-7-4-3-5-8-21/h3-11,16-18H,12-15H2,1-2H3,(H,32,37)