3-[1,3-dimethyl-2,4-bis(oxidanylidene)-5-phenyl-pyrrolo[3,4-d]pyrimidin-6-yl]benzenecarbonitrile

Systemtic Name: 3-[1,3-dimethyl-2,4-bis(oxidanylidene)-5-phenyl-pyrrolo[3,4-d]pyrimidin-6-yl]benzenecarbonitrile Openeye Name: 3-(1,3-dimethyl-2,4-dioxo-5-phenyl-pyrrolo[3,4-d]pyrimidin-6-yl)benzonitrile CAS Name: 3-(1,3-dimethyl-2,4-dioxo-5-phenyl-6-pyrrolo[3,4-d]pyrimidinyl)benzonitrile IUPAC Name: 3-(1,3-dimethyl-2,4-dioxo-5-phenylpyrrolo[3,4-d]pyrimidin-6-yl)benzonitrile Traditional Name: 3-(2,4-diketo-1,3-dimethyl-5-phenyl-pyrrolo[3,4-d]pyrimidin-6-yl)benzonitrile Formula: C21H16N4O2 MolecularWeight: 356.37734

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CN(C(=C2C(=O)N(C1=O)C)C3=CC=CC=C3)C4=CC=CC(=C4)C#N

Isomeric SMILES

CN1C2=CN(C(=C2C(=O)N(C1=O)C)C3=CC=CC=C3)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C21H16N4O2/c1-23-17-13-25(16-10-6-7-14(11-16)12-22)19(15-8-4-3-5-9-15)18(17)20(26)24(2)21(23)27/h3-11,13H,1-2H3