3-[2-(5-methyl-1,2,4-triazin-3-yl)ethynyl]benzenecarbonitrile

Systemtic Name: 3-[2-(5-methyl-1,2,4-triazin-3-yl)ethynyl]benzenecarbonitrile Openeye Name: 3-[2-(5-methyl-1,2,4-triazin-3-yl)ethynyl]benzonitrile CAS Name: 3-[2-(5-methyl-1,2,4-triazin-3-yl)ethynyl]benzonitrile IUPAC Name: 3-[2-(5-methyl-1,2,4-triazin-3-yl)ethynyl]benzonitrile Traditional Name: 3-[2-(5-methyl-1,2,4-triazin-3-yl)ethynyl]benzonitrile Formula: C13H8N4 MolecularWeight: 220.22942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=NC(=N1)C#CC2=CC(=CC=C2)C#N

Isomeric SMILES

CC1=CN=NC(=N1)C#CC2=CC(=CC=C2)C#N

InChI

InChI=1S/C13H8N4/c1-10-9-15-17-13(16-10)6-5-11-3-2-4-12(7-11)8-14/h2-4,7,9H,1H3