6-phenyl-N-[2-(propylcarbamoyl)phenyl]-1-(pyridin-4-ylmethyl)pyrazolo[3,4-b]pyridine-4-carboxamide

Systemtic Name: 6-phenyl-N-[2-(propylcarbamoyl)phenyl]-1-(pyridin-4-ylmethyl)pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: 6-phenyl-N-[2-(propylcarbamoyl)phenyl]-1-(4-pyridylmethyl)pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: N-[2-[oxo(propylamino)methyl]phenyl]-6-phenyl-1-(pyridin-4-ylmethyl)-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 6-phenyl-N-[2-(propylcarbamoyl)phenyl]-1-(pyridin-4-ylmethyl)pyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: 6-phenyl-N-[2-(propylcarbamoyl)phenyl]-1-(4-pyridylmethyl)pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C29H26N6O2 MolecularWeight: 490.55574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC=CC=C1NC(=O)C2=CC(=NC3=C2C=NN3CC4=CC=NC=C4)C5=CC=CC=C5

Isomeric SMILES

CCCNC(=O)C1=CC=CC=C1NC(=O)C2=CC(=NC3=C2C=NN3CC4=CC=NC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H26N6O2/c1-2-14-31-28(36)22-10-6-7-11-25(22)34-29(37)23-17-26(21-8-4-3-5-9-21)33-27-24(23)18-32-35(27)19-20-12-15-30-16-13-20/h3-13,15-18H,2,14,19H2,1H3,(H,31,36)(H,34,37)