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

Systemtic Name: 3-[3-butyl-2,6-bis(oxidanylidene)-7-pentyl-purin-8-yl]-N-cyclooctyl-propanamide Openeye Name: 3-(3-butyl-2,6-dioxo-7-pentyl-purin-8-yl)-N-cyclooctyl-propanamide CAS Name: 3-(3-butyl-2,6-dioxo-7-pentyl-8-purinyl)-N-cyclooctylpropanamide IUPAC Name: 3-(3-butyl-2,6-dioxo-7-pentylpurin-8-yl)-N-cyclooctylpropanamide Traditional Name: 3-(7-amyl-3-butyl-2,6-diketo-purin-8-yl)-N-cyclooctyl-propionamide Formula: C25H41N5O3 MolecularWeight: 459.62474

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=NC2=C1C(=O)NC(=O)N2CCCC)CCC(=O)NC3CCCCCCC3

Isomeric SMILES

CCCCCN1C(=NC2=C1C(=O)NC(=O)N2CCCC)CCC(=O)NC3CCCCCCC3

InChI

InChI=1S/C25H41N5O3/c1-3-5-12-18-29-20(15-16-21(31)26-19-13-10-8-7-9-11-14-19)27-23-22(29)24(32)28-25(33)30(23)17-6-4-2/h19H,3-18H2,1-2H3,(H,26,31)(H,28,32,33)