5-[2-oxidanylidene-2-(3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-[2-oxidanylidene-2-(3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-[2-oxo-2-(3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-[2-oxo-2-(3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethyl]-1-phenyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-[2-oxo-2-(3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethyl]-1-phenylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-[2-keto-2-(3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C27H21N5O3 MolecularWeight: 463.48734

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C2=CC=CC=C2O1)C(=O)CN3C=NC4=C(C3=O)C=NN4C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1C(N(C2=CC=CC=C2O1)C(=O)CN3C=NC4=C(C3=O)C=NN4C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C27H21N5O3/c33-25(31-22-13-7-8-14-24(22)35-17-23(31)19-9-3-1-4-10-19)16-30-18-28-26-21(27(30)34)15-29-32(26)20-11-5-2-6-12-20/h1-15,18,23H,16-17H2