N-[1-(3-chlorophenyl)-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl]-2,2-diphenyl-ethanamide

Systemtic Name: N-[1-(3-chlorophenyl)-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl]-2,2-diphenyl-ethanamide Openeye Name: N-[1-(3-chlorophenyl)-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl]-2,2-diphenyl-acetamide CAS Name: N-[1-(3-chlorophenyl)-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl]-2,2-diphenylacetamide IUPAC Name: N-[1-(3-chlorophenyl)-4-oxopyrazolo[3,4-d]pyrimidin-5-yl]-2,2-diphenylacetamide Traditional Name: N-[1-(3-chlorophenyl)-4-keto-pyrazolo[3,4-d]pyrimidin-5-yl]-2,2-diphenyl-acetamide Formula: C25H18ClN5O2 MolecularWeight: 455.89572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)NN3C=NC4=C(C3=O)C=NN4C5=CC(=CC=C5)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)NN3C=NC4=C(C3=O)C=NN4C5=CC(=CC=C5)Cl

InChI

InChI=1S/C25H18ClN5O2/c26-19-12-7-13-20(14-19)31-23-21(15-28-31)25(33)30(16-27-23)29-24(32)22(17-8-3-1-4-9-17)18-10-5-2-6-11-18/h1-16,22H,(H,29,32)