4-[4-azanyl-1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-5-yl]carbonylbenzenecarbonitrile

Systemtic Name: 4-[4-azanyl-1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-5-yl]carbonylbenzenecarbonitrile Openeye Name: 4-(4-amino-1,3-dimethyl-2,6-dioxo-pyrimidine-5-carbonyl)benzonitrile CAS Name: 4-[(4-amino-1,3-dimethyl-2,6-dioxo-5-pyrimidinyl)-oxomethyl]benzonitrile IUPAC Name: 4-(4-amino-1,3-dimethyl-2,6-dioxopyrimidine-5-carbonyl)benzonitrile Traditional Name: 4-(4-amino-2,6-diketo-1,3-dimethyl-pyrimidine-5-carbonyl)benzonitrile Formula: C14H12N4O3 MolecularWeight: 284.27008

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12N4O3/c1-17-12(16)10(13(20)18(2)14(17)21)11(19)9-5-3-8(7-15)4-6-9/h3-6H,16H2,1-2H3