4-[(4-oxidanylidene-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)methyl]-N-phenyl-benzamide

Systemtic Name: 4-[(4-oxidanylidene-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)methyl]-N-phenyl-benzamide Openeye Name: 4-[(4-oxo-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)methyl]-N-phenyl-benzamide CAS Name: 4-[(4-oxo-1-phenyl-5-pyrazolo[3,4-d]pyrimidinyl)methyl]-N-phenylbenzamide IUPAC Name: 4-[(4-oxo-1-phenylpyrazolo[3,4-d]pyrimidin-5-yl)methyl]-N-phenylbenzamide Traditional Name: 4-[(4-keto-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)methyl]-N-phenyl-benzamide Formula: C25H19N5O2 MolecularWeight: 421.45066

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)CN3C=NC4=C(C3=O)C=NN4C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)CN3C=NC4=C(C3=O)C=NN4C5=CC=CC=C5

InChI

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