2-azanyl-3-(1,3-dihydro-2,1,3-benzoxadiazol-5-ylmethyl)-7-(naphthalen-2-ylmethyl)purin-6-one

Systemtic Name: 2-azanyl-3-(1,3-dihydro-2,1,3-benzoxadiazol-5-ylmethyl)-7-(naphthalen-2-ylmethyl)purin-6-one Openeye Name: 2-amino-3-(1,3-dihydro-2,1,3-benzoxadiazol-5-ylmethyl)-7-(2-naphthylmethyl)purin-6-one CAS Name: 2-amino-3-(1,3-dihydro-2,1,3-benzoxadiazol-5-ylmethyl)-7-(2-naphthalenylmethyl)-6-purinone IUPAC Name: 2-amino-3-(1,3-dihydro-2,1,3-benzoxadiazol-5-ylmethyl)-7-(naphthalen-2-ylmethyl)purin-6-one Traditional Name: 2-amino-3-(1,3-dihydrobenzofurazan-5-ylmethyl)-7-(2-naphthylmethyl)purin-6-one Formula: C23H19N7O2 MolecularWeight: 425.44266

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=CC6=C(C=C5)NON6)N

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)CN3C=NC4=C3C(=O)N=C(N4CC5=CC6=C(C=C5)NON6)N

InChI

InChI=1S/C23H19N7O2/c24-23-26-22(31)20-21(30(23)12-15-6-8-18-19(10-15)28-32-27-18)25-13-29(20)11-14-5-7-16-3-1-2-4-17(16)9-14/h1-10,13,27-28H,11-12H2,(H2,24,26,31)