9-[[3-[(6-aminopurin-9-yl)methyl]phenyl]methyl]purin-6-amine

Systemtic Name: 9-[[3-[(6-aminopurin-9-yl)methyl]phenyl]methyl]purin-6-amine Openeye Name: 9-[[3-[(6-aminopurin-9-yl)methyl]phenyl]methyl]purin-6-amine CAS Name: 9-[[3-[(6-aminopurin-9-yl)methyl]phenyl]methyl]-6-purinamine IUPAC Name: 9-[[3-[(6-aminopurin-9-yl)methyl]phenyl]methyl]purin-6-amine Traditional Name: [9-[3-(adenin-9-ylmethyl)benzyl]purin-6-yl]amine Formula: C18H16N10 MolecularWeight: 372.38664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CN2C=NC3=C2N=CN=C3N)CN4C=NC5=C4N=CN=C5N

Isomeric SMILES

C1=CC(=CC(=C1)CN2C=NC3=C2N=CN=C3N)CN4C=NC5=C4N=CN=C5N

InChI

InChI=1S/C18H16N10/c19-15-13-17(23-7-21-15)27(9-25-13)5-11-2-1-3-12(4-11)6-28-10-26-14-16(20)22-8-24-18(14)28/h1-4,7-10H,5-6H2,(H2,19,21,23)(H2,20,22,24)