3-[3-butyl-7-(2-methylpropyl)-2,6-bis(oxidanylidene)purin-8-yl]-N-(5-tert-butyl-2-oxidanyl-phenyl)propanamide

Systemtic Name: 3-[3-butyl-7-(2-methylpropyl)-2,6-bis(oxidanylidene)purin-8-yl]-N-(5-tert-butyl-2-oxidanyl-phenyl)propanamide Openeye Name: N-(5-tert-butyl-2-hydroxy-phenyl)-3-(3-butyl-7-isobutyl-2,6-dioxo-purin-8-yl)propanamide CAS Name: N-(5-tert-butyl-2-hydroxyphenyl)-3-[3-butyl-7-(2-methylpropyl)-2,6-dioxo-8-purinyl]propanamide IUPAC Name: N-(5-tert-butyl-2-hydroxyphenyl)-3-[3-butyl-7-(2-methylpropyl)-2,6-dioxopurin-8-yl]propanamide Traditional Name: N-(5-tert-butyl-2-hydroxy-phenyl)-3-(3-butyl-7-isobutyl-2,6-diketo-purin-8-yl)propionamide Formula: C26H37N5O4 MolecularWeight: 483.60308

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=O)NC1=O)N(C(=N2)CCC(=O)NC3=C(C=CC(=C3)C(C)(C)C)O)CC(C)C

Isomeric SMILES

CCCCN1C2=C(C(=O)NC1=O)N(C(=N2)CCC(=O)NC3=C(C=CC(=C3)C(C)(C)C)O)CC(C)C

InChI

InChI=1S/C26H37N5O4/c1-7-8-13-30-23-22(24(34)29-25(30)35)31(15-16(2)3)20(28-23)11-12-21(33)27-18-14-17(26(4,5)6)9-10-19(18)32/h9-10,14,16,32H,7-8,11-13,15H2,1-6H3,(H,27,33)(H,29,34,35)