3-[(4-aminophenyl)methyl]-2-azanyl-7-(naphthalen-2-ylmethyl)purin-6-one

Systemtic Name: 3-[(4-aminophenyl)methyl]-2-azanyl-7-(naphthalen-2-ylmethyl)purin-6-one Openeye Name: 2-amino-3-[(4-aminophenyl)methyl]-7-(2-naphthylmethyl)purin-6-one CAS Name: 2-amino-3-[(4-aminophenyl)methyl]-7-(2-naphthalenylmethyl)-6-purinone IUPAC Name: 2-amino-3-[(4-aminophenyl)methyl]-7-(naphthalen-2-ylmethyl)purin-6-one Traditional Name: 2-amino-3-(4-aminobenzyl)-7-(2-naphthylmethyl)purin-6-one Formula: C23H20N6O MolecularWeight: 396.4445

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)CN3C=NC4=C3C(=O)N=C(N4CC5=CC=C(C=C5)N)N

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)CN3C=NC4=C3C(=O)N=C(N4CC5=CC=C(C=C5)N)N

InChI

InChI=1S/C23H20N6O/c24-19-9-6-15(7-10-19)13-29-21-20(22(30)27-23(29)25)28(14-26-21)12-16-5-8-17-3-1-2-4-18(17)11-16/h1-11,14H,12-13,24H2,(H2,25,27,30)