6-azanyl-3-[8-(3-fluorophenyl)purin-9-yl]-2-iodanyl-benzenecarboximidamide

Systemtic Name: 6-azanyl-3-[8-(3-fluorophenyl)purin-9-yl]-2-iodanyl-benzenecarboximidamide Openeye Name: 6-amino-3-[8-(3-fluorophenyl)purin-9-yl]-2-iodo-benzamidine CAS Name: 6-amino-3-[8-(3-fluorophenyl)-9-purinyl]-2-iodobenzenecarboximidamide IUPAC Name: 6-amino-3-[8-(3-fluorophenyl)purin-9-yl]-2-iodobenzenecarboximidamide Traditional Name: 6-amino-3-[8-(3-fluorophenyl)purin-9-yl]-2-iodo-benzamidine Formula: C18H13FIN7 MolecularWeight: 473.245593

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)C2=NC3=CN=CN=C3N2C4=C(C(=C(C=C4)N)C(=N)N)I

Isomeric SMILES

C1=CC(=CC(=C1)F)C2=NC3=CN=CN=C3N2C4=C(C(=C(C=C4)N)C(=N)N)I

InChI

InChI=1S/C18H13FIN7/c19-10-3-1-2-9(6-10)17-26-12-7-24-8-25-18(12)27(17)13-5-4-11(21)14(15(13)20)16(22)23/h1-8H,21H2,(H3,22,23)