9-[3,5-bis(fluoranyl)phenyl]-6-(ethylamino)purine-2-carbonitrile

Systemtic Name: 9-[3,5-bis(fluoranyl)phenyl]-6-(ethylamino)purine-2-carbonitrile Openeye Name: 9-(3,5-difluorophenyl)-6-(ethylamino)purine-2-carbonitrile CAS Name: 9-(3,5-difluorophenyl)-6-(ethylamino)-2-purinecarbonitrile IUPAC Name: 9-(3,5-difluorophenyl)-6-(ethylamino)purine-2-carbonitrile Traditional Name: 9-(3,5-difluorophenyl)-6-(ethylamino)purine-2-carbonitrile Formula: C14H10F2N6 MolecularWeight: 300.266206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=NC2=C1N=CN2C3=CC(=CC(=C3)F)F)C#N

Isomeric SMILES

CCNC1=NC(=NC2=C1N=CN2C3=CC(=CC(=C3)F)F)C#N

InChI

InChI=1S/C14H10F2N6/c1-2-18-13-12-14(21-11(6-17)20-13)22(7-19-12)10-4-8(15)3-9(16)5-10/h3-5,7H,2H2,1H3,(H,18,20,21)