4-[[1,3-dimethyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]methylamino]benzenecarbonitrile

Systemtic Name: 4-[[1,3-dimethyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]methylamino]benzenecarbonitrile Openeye Name: 4-[(1,3-dimethyl-2,4-dioxo-pyrimidin-5-yl)methylamino]benzonitrile CAS Name: 4-[(1,3-dimethyl-2,4-dioxo-5-pyrimidinyl)methylamino]benzonitrile IUPAC Name: 4-[(1,3-dimethyl-2,4-dioxopyrimidin-5-yl)methylamino]benzonitrile Traditional Name: 4-[(2,4-diketo-1,3-dimethyl-pyrimidin-5-yl)methylamino]benzonitrile Formula: C14H14N4O2 MolecularWeight: 270.28656

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)N(C1=O)C)CNC2=CC=C(C=C2)C#N

Isomeric SMILES

CN1C=C(C(=O)N(C1=O)C)CNC2=CC=C(C=C2)C#N

InChI

InChI=1S/C14H14N4O2/c1-17-9-11(13(19)18(2)14(17)20)8-16-12-5-3-10(7-15)4-6-12/h3-6,9,16H,8H2,1-2H3