3-[3,7-dibutyl-2,6-bis(oxidanylidene)purin-8-yl]-N-[(4-ethoxyphenyl)methyl]-N-methyl-propanamide

Systemtic Name: 3-[3,7-dibutyl-2,6-bis(oxidanylidene)purin-8-yl]-N-[(4-ethoxyphenyl)methyl]-N-methyl-propanamide Openeye Name: 3-(3,7-dibutyl-2,6-dioxo-purin-8-yl)-N-[(4-ethoxyphenyl)methyl]-N-methyl-propanamide CAS Name: 3-(3,7-dibutyl-2,6-dioxo-8-purinyl)-N-[(4-ethoxyphenyl)methyl]-N-methylpropanamide IUPAC Name: 3-(3,7-dibutyl-2,6-dioxopurin-8-yl)-N-[(4-ethoxyphenyl)methyl]-N-methylpropanamide Traditional Name: 3-(3,7-dibutyl-2,6-diketo-purin-8-yl)-N-(4-ethoxybenzyl)-N-methyl-propionamide Formula: C26H37N5O4 MolecularWeight: 483.60308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NC2=C1C(=O)NC(=O)N2CCCC)CCC(=O)N(C)CC3=CC=C(C=C3)OCC

Isomeric SMILES

CCCCN1C(=NC2=C1C(=O)NC(=O)N2CCCC)CCC(=O)N(C)CC3=CC=C(C=C3)OCC

InChI

InChI=1S/C26H37N5O4/c1-5-8-16-30-21(27-24-23(30)25(33)28-26(34)31(24)17-9-6-2)14-15-22(32)29(4)18-19-10-12-20(13-11-19)35-7-3/h10-13H,5-9,14-18H2,1-4H3,(H,28,33,34)