4-[(5-chloranyl-6-oxidanylidene-1H-pyrimidin-2-yl)amino]benzenecarbonitrile

Systemtic Name: 4-[(5-chloranyl-6-oxidanylidene-1H-pyrimidin-2-yl)amino]benzenecarbonitrile Openeye Name: 4-[(5-chloro-6-oxo-1H-pyrimidin-2-yl)amino]benzonitrile CAS Name: 4-[(5-chloro-6-oxo-1H-pyrimidin-2-yl)amino]benzonitrile IUPAC Name: 4-[(5-chloro-6-oxo-1H-pyrimidin-2-yl)amino]benzonitrile Traditional Name: 4-[(5-chloro-6-keto-1H-pyrimidin-2-yl)amino]benzonitrile Formula: C11H7ClN4O MolecularWeight: 246.65248

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)NC2=NC=C(C(=O)N2)Cl

Isomeric SMILES

C1=CC(=CC=C1C#N)NC2=NC=C(C(=O)N2)Cl

InChI

InChI=1S/C11H7ClN4O/c12-9-6-14-11(16-10(9)17)15-8-3-1-7(5-13)2-4-8/h1-4,6H,(H2,14,15,16,17)