2-[3,7-dibutyl-2,6-bis(oxidanylidene)purin-1-yl]-N-(1-phenylethyl)ethanamide

Systemtic Name: 2-[3,7-dibutyl-2,6-bis(oxidanylidene)purin-1-yl]-N-(1-phenylethyl)ethanamide Openeye Name: 2-(3,7-dibutyl-2,6-dioxo-purin-1-yl)-N-(1-phenylethyl)acetamide CAS Name: 2-(3,7-dibutyl-2,6-dioxo-1-purinyl)-N-(1-phenylethyl)acetamide IUPAC Name: 2-(3,7-dibutyl-2,6-dioxopurin-1-yl)-N-(1-phenylethyl)acetamide Traditional Name: 2-(3,7-dibutyl-2,6-diketo-purin-1-yl)-N-(1-phenylethyl)acetamide Formula: C23H31N5O3 MolecularWeight: 425.52394

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31N5O3/c1-4-6-13-26-16-24-21-20(26)22(30)28(23(31)27(21)14-7-5-2)15-19(29)25-17(3)18-11-9-8-10-12-18/h8-12,16-17H,4-7,13-15H2,1-3H3,(H,25,29)