N-(phenylmethyl)-3-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-benzamide

Systemtic Name: N-(phenylmethyl)-3-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-benzamide Openeye Name: N-benzyl-3-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-benzamide CAS Name: N-(phenylmethyl)-3-[(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)oxy]benzamide IUPAC Name: N-benzyl-3-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)oxybenzamide Traditional Name: N-benzyl-3-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-benzamide Formula: C25H19N5O2 MolecularWeight: 421.45066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C2=CC(=CC=C2)OC3=NC=NC4=C3C=NN4C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C2=CC(=CC=C2)OC3=NC=NC4=C3C=NN4C5=CC=CC=C5

InChI

InChI=1S/C25H19N5O2/c31-24(26-15-18-8-3-1-4-9-18)19-10-7-13-21(14-19)32-25-22-16-29-30(23(22)27-17-28-25)20-11-5-2-6-12-20/h1-14,16-17H,15H2,(H,26,31)