3-methyl-5-(2-pyrimidin-5-ylethynyl)benzenecarbonitrile

Systemtic Name: 3-methyl-5-(2-pyrimidin-5-ylethynyl)benzenecarbonitrile Openeye Name: 3-methyl-5-(2-pyrimidin-5-ylethynyl)benzonitrile CAS Name: 3-methyl-5-[2-(5-pyrimidinyl)ethynyl]benzonitrile IUPAC Name: 3-methyl-5-(2-pyrimidin-5-ylethynyl)benzonitrile Traditional Name: 3-methyl-5-[2-(5-pyrimidyl)ethynyl]benzonitrile Formula: C14H9N3 MolecularWeight: 219.24136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C#N)C#CC2=CN=CN=C2

Isomeric SMILES

CC1=CC(=CC(=C1)C#N)C#CC2=CN=CN=C2

InChI

InChI=1S/C14H9N3/c1-11-4-12(6-14(5-11)7-15)2-3-13-8-16-10-17-9-13/h4-6,8-10H,1H3