3-[3-butyl-7-(2-methylpropyl)-2,6-bis(oxidanylidene)purin-8-yl]-N-(2-ethylhexyl)propanamide

Systemtic Name: 3-[3-butyl-7-(2-methylpropyl)-2,6-bis(oxidanylidene)purin-8-yl]-N-(2-ethylhexyl)propanamide Openeye Name: 3-(3-butyl-7-isobutyl-2,6-dioxo-purin-8-yl)-N-(2-ethylhexyl)propanamide CAS Name: 3-[3-butyl-7-(2-methylpropyl)-2,6-dioxo-8-purinyl]-N-(2-ethylhexyl)propanamide IUPAC Name: 3-[3-butyl-7-(2-methylpropyl)-2,6-dioxopurin-8-yl]-N-(2-ethylhexyl)propanamide Traditional Name: 3-(3-butyl-7-isobutyl-2,6-diketo-purin-8-yl)-N-(2-ethylhexyl)propionamide Formula: C24H41N5O3 MolecularWeight: 447.61404

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=O)CCC1=NC2=C(N1CC(C)C)C(=O)NC(=O)N2CCCC

Isomeric SMILES

CCCCC(CC)CNC(=O)CCC1=NC2=C(N1CC(C)C)C(=O)NC(=O)N2CCCC

InChI

InChI=1S/C24H41N5O3/c1-6-9-11-18(8-3)15-25-20(30)13-12-19-26-22-21(29(19)16-17(4)5)23(31)27-24(32)28(22)14-10-7-2/h17-18H,6-16H2,1-5H3,(H,25,30)(H,27,31,32)