1,3-dimethyl-2,4-bis(oxidanylidene)-6,8-diphenyl-purino[7,8-a]pyrimidine-7-carbonitrile

Systemtic Name: 1,3-dimethyl-2,4-bis(oxidanylidene)-6,8-diphenyl-purino[7,8-a]pyrimidine-7-carbonitrile Openeye Name: 1,3-dimethyl-2,4-dioxo-6,8-diphenyl-purino[7,8-a]pyrimidine-7-carbonitrile CAS Name: 1,3-dimethyl-2,4-dioxo-6,8-diphenyl-7-purino[7,8-a]pyrimidinecarbonitrile IUPAC Name: 1,3-dimethyl-2,4-dioxo-6,8-diphenylpurino[7,8-a]pyrimidine-7-carbonitrile Traditional Name: 2,4-diketo-1,3-dimethyl-6,8-diphenyl-purino[7,8-a]pyrimidine-7-carbonitrile Formula: C23H16N6O2 MolecularWeight: 408.41214

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N3C(=C(C(=NC3=N2)C4=CC=CC=C4)C#N)C5=CC=CC=C5

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N3C(=C(C(=NC3=N2)C4=CC=CC=C4)C#N)C5=CC=CC=C5

InChI

InChI=1S/C23H16N6O2/c1-27-20-19(21(30)28(2)23(27)31)29-18(15-11-7-4-8-12-15)16(13-24)17(25-22(29)26-20)14-9-5-3-6-10-14/h3-12H,1-2H3