2-[4-[[2,4,6-tris(azanyl)pyrimidin-5-yl]diazenyl]phenyl]ethanenitrile

Systemtic Name: 2-[4-[[2,4,6-tris(azanyl)pyrimidin-5-yl]diazenyl]phenyl]ethanenitrile Openeye Name: 2-[4-(2,4,6-triaminopyrimidin-5-yl)azophenyl]acetonitrile CAS Name: 2-[4-[(2,4,6-triamino-5-pyrimidinyl)azo]phenyl]acetonitrile IUPAC Name: 2-[4-[(2,4,6-triaminopyrimidin-5-yl)diazenyl]phenyl]acetonitrile Traditional Name: 2-[4-(2,4,6-triaminopyrimidin-5-yl)azophenyl]acetonitrile Formula: C12H12N8 MolecularWeight: 268.27728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC#N)N=NC2=C(N=C(N=C2N)N)N

Isomeric SMILES

C1=CC(=CC=C1CC#N)N=NC2=C(N=C(N=C2N)N)N

InChI

InChI=1S/C12H12N8/c13-6-5-7-1-3-8(4-2-7)19-20-9-10(14)17-12(16)18-11(9)15/h1-4H,5H2,(H6,14,15,16,17,18)