2-[9-(4-fluorophenyl)-2-methyl-1H-purin-6-ylidene]propanedinitrile

Systemtic Name: 2-[9-(4-fluorophenyl)-2-methyl-1H-purin-6-ylidene]propanedinitrile Openeye Name: 2-[9-(4-fluorophenyl)-2-methyl-1H-purin-6-ylidene]propanedinitrile CAS Name: 2-[9-(4-fluorophenyl)-2-methyl-1H-purin-6-ylidene]propanedinitrile IUPAC Name: 2-[9-(4-fluorophenyl)-2-methyl-1H-purin-6-ylidene]propanedinitrile Traditional Name: 2-[9-(4-fluorophenyl)-2-methyl-1H-purin-6-ylidene]malononitrile Formula: C15H9FN6 MolecularWeight: 292.270563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=C(C#N)C#N)N1)N=CN2C3=CC=C(C=C3)F

Isomeric SMILES

CC1=NC2=C(C(=C(C#N)C#N)N1)N=CN2C3=CC=C(C=C3)F

InChI

InChI=1S/C15H9FN6/c1-9-20-13(10(6-17)7-18)14-15(21-9)22(8-19-14)12-4-2-11(16)3-5-12/h2-5,8H,1H3,(H,20,21)