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

Systemtic Name: 3-[3-butyl-7-(2-methylpropyl)-2,6-bis(oxidanylidene)purin-8-yl]-N-hexyl-propanamide Openeye Name: 3-(3-butyl-7-isobutyl-2,6-dioxo-purin-8-yl)-N-hexyl-propanamide CAS Name: 3-[3-butyl-7-(2-methylpropyl)-2,6-dioxo-8-purinyl]-N-hexylpropanamide IUPAC Name: 3-[3-butyl-7-(2-methylpropyl)-2,6-dioxopurin-8-yl]-N-hexylpropanamide Traditional Name: 3-(3-butyl-7-isobutyl-2,6-diketo-purin-8-yl)-N-hexyl-propionamide Formula: C22H37N5O3 MolecularWeight: 419.56088

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)CCC1=NC2=C(N1CC(C)C)C(=O)NC(=O)N2CCCC

Isomeric SMILES

CCCCCCNC(=O)CCC1=NC2=C(N1CC(C)C)C(=O)NC(=O)N2CCCC

InChI

InChI=1S/C22H37N5O3/c1-5-7-9-10-13-23-18(28)12-11-17-24-20-19(27(17)15-16(3)4)21(29)25-22(30)26(20)14-8-6-2/h16H,5-15H2,1-4H3,(H,23,28)(H,25,29,30)