6-(3-ethoxypropyl)-4,7-dimethyl-2-(naphthalen-1-ylmethyl)purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 6-(3-ethoxypropyl)-4,7-dimethyl-2-(naphthalen-1-ylmethyl)purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-(3-ethoxypropyl)-4,7-dimethyl-2-(1-naphthylmethyl)purino[7,8-a]imidazole-1,3-dione CAS Name: 6-(3-ethoxypropyl)-4,7-dimethyl-2-(1-naphthalenylmethyl)purino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-(3-ethoxypropyl)-4,7-dimethyl-2-(naphthalen-1-ylmethyl)purino[7,8-a]imidazole-1,3-dione Traditional Name: 6-(3-ethoxypropyl)-4,7-dimethyl-2-(1-naphthylmethyl)purin[7,8-a]imidazole-1,3-quinone Formula: C25H27N5O3 MolecularWeight: 445.51358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN1C(=CN2C1=NC3=C2C(=O)N(C(=O)N3C)CC4=CC=CC5=CC=CC=C54)C

Isomeric SMILES

CCOCCCN1C(=CN2C1=NC3=C2C(=O)N(C(=O)N3C)CC4=CC=CC5=CC=CC=C54)C

InChI

InChI=1S/C25H27N5O3/c1-4-33-14-8-13-28-17(2)15-29-21-22(26-24(28)29)27(3)25(32)30(23(21)31)16-19-11-7-10-18-9-5-6-12-20(18)19/h5-7,9-12,15H,4,8,13-14,16H2,1-3H3