3-[2-(4-fluorophenyl)ethynyl]-7H-pyrrolo[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[2-(4-fluorophenyl)ethynyl]-7H-pyrrolo[2,3-d]pyrimidin-4-one Openeye Name: 3-[2-(4-fluorophenyl)ethynyl]-7H-pyrrolo[2,3-d]pyrimidin-4-one CAS Name: 3-[2-(4-fluorophenyl)ethynyl]-7H-pyrrolo[2,3-d]pyrimidin-4-one IUPAC Name: 3-[2-(4-fluorophenyl)ethynyl]-7H-pyrrolo[2,3-d]pyrimidin-4-one Traditional Name: 3-[2-(4-fluorophenyl)ethynyl]-7H-pyrrolo[2,3-d]pyrimidin-4-one Formula: C14H8FN3O MolecularWeight: 253.231223

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#CN2C=NC3=C(C2=O)C=CN3)F

Isomeric SMILES

C1=CC(=CC=C1C#CN2C=NC3=C(C2=O)C=CN3)F

InChI

InChI=1S/C14H8FN3O/c15-11-3-1-10(2-4-11)6-8-18-9-17-13-12(14(18)19)5-7-16-13/h1-5,7,9,16H