3-[3,7-dibutyl-2,6-bis(oxidanylidene)purin-8-yl]-N-[(2-methoxy-5-methyl-phenyl)methyl]-N-methyl-propanamide

Systemtic Name: 3-[3,7-dibutyl-2,6-bis(oxidanylidene)purin-8-yl]-N-[(2-methoxy-5-methyl-phenyl)methyl]-N-methyl-propanamide Openeye Name: 3-(3,7-dibutyl-2,6-dioxo-purin-8-yl)-N-[(2-methoxy-5-methyl-phenyl)methyl]-N-methyl-propanamide CAS Name: 3-(3,7-dibutyl-2,6-dioxo-8-purinyl)-N-[(2-methoxy-5-methylphenyl)methyl]-N-methylpropanamide IUPAC Name: 3-(3,7-dibutyl-2,6-dioxopurin-8-yl)-N-[(2-methoxy-5-methylphenyl)methyl]-N-methylpropanamide Traditional Name: 3-(3,7-dibutyl-2,6-diketo-purin-8-yl)-N-(2-methoxy-5-methyl-benzyl)-N-methyl-propionamide Formula: C26H37N5O4 MolecularWeight: 483.60308

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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