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

Systemtic Name: 1-methyl-5-[2-oxidanylidene-2-(3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethyl]pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-methyl-5-[2-oxo-2-(3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethyl]pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-methyl-5-[2-oxo-2-(3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethyl]-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 1-methyl-5-[2-oxo-2-(3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethyl]pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-[2-keto-2-(3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethyl]-1-methyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C22H19N5O3 MolecularWeight: 401.41796

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=O)N(C=N2)CC(=O)N3C(COC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CN1C2=C(C=N1)C(=O)N(C=N2)CC(=O)N3C(COC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C22H19N5O3/c1-25-21-16(11-24-25)22(29)26(14-23-21)12-20(28)27-17-9-5-6-10-19(17)30-13-18(27)15-7-3-2-4-8-15/h2-11,14,18H,12-13H2,1H3