3-[(2-chloranyl-5-fluoranyl-pyrimidin-4-yl)amino]benzenecarbonitrile

Systemtic Name: 3-[(2-chloranyl-5-fluoranyl-pyrimidin-4-yl)amino]benzenecarbonitrile Openeye Name: 3-[(2-chloro-5-fluoro-pyrimidin-4-yl)amino]benzonitrile CAS Name: 3-[(2-chloro-5-fluoro-4-pyrimidinyl)amino]benzonitrile IUPAC Name: 3-[(2-chloro-5-fluoropyrimidin-4-yl)amino]benzonitrile Traditional Name: 3-[(2-chloro-5-fluoro-pyrimidin-4-yl)amino]benzonitrile Formula: C11H6ClFN4 MolecularWeight: 248.643543

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=NC(=NC=C2F)Cl)C#N

Isomeric SMILES

C1=CC(=CC(=C1)NC2=NC(=NC=C2F)Cl)C#N

InChI

InChI=1S/C11H6ClFN4/c12-11-15-6-9(13)10(17-11)16-8-3-1-2-7(4-8)5-14/h1-4,6H,(H,15,16,17)