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

Systemtic Name: 3-[2-(4-methylphenyl)ethynyl]-7H-pyrrolo[2,3-d]pyrimidin-4-one Openeye Name: 3-[2-(p-tolyl)ethynyl]-7H-pyrrolo[2,3-d]pyrimidin-4-one CAS Name: 3-[2-(4-methylphenyl)ethynyl]-7H-pyrrolo[2,3-d]pyrimidin-4-one IUPAC Name: 3-[2-(4-methylphenyl)ethynyl]-7H-pyrrolo[2,3-d]pyrimidin-4-one Traditional Name: 3-[2-(p-tolyl)ethynyl]-7H-pyrrolo[2,3-d]pyrimidin-4-one Formula: C15H11N3O MolecularWeight: 249.26734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C#CN2C=NC3=C(C2=O)C=CN3

Isomeric SMILES

CC1=CC=C(C=C1)C#CN2C=NC3=C(C2=O)C=CN3

InChI

InChI=1S/C15H11N3O/c1-11-2-4-12(5-3-11)7-9-18-10-17-14-13(15(18)19)6-8-16-14/h2-6,8,10,16H,1H3