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

Systemtic Name: 3-[3-butyl-2,6-bis(oxidanylidene)-7-pentyl-purin-8-yl]-N-(2-methylcyclohexyl)propanamide Openeye Name: 3-(3-butyl-2,6-dioxo-7-pentyl-purin-8-yl)-N-(2-methylcyclohexyl)propanamide CAS Name: 3-(3-butyl-2,6-dioxo-7-pentyl-8-purinyl)-N-(2-methylcyclohexyl)propanamide IUPAC Name: 3-(3-butyl-2,6-dioxo-7-pentylpurin-8-yl)-N-(2-methylcyclohexyl)propanamide Traditional Name: 3-(7-amyl-3-butyl-2,6-diketo-purin-8-yl)-N-(2-methylcyclohexyl)propionamide Formula: C24H39N5O3 MolecularWeight: 445.59816

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=NC2=C1C(=O)NC(=O)N2CCCC)CCC(=O)NC3CCCCC3C

Isomeric SMILES

CCCCCN1C(=NC2=C1C(=O)NC(=O)N2CCCC)CCC(=O)NC3CCCCC3C

InChI

InChI=1S/C24H39N5O3/c1-4-6-10-16-28-19(13-14-20(30)25-18-12-9-8-11-17(18)3)26-22-21(28)23(31)27-24(32)29(22)15-7-5-2/h17-18H,4-16H2,1-3H3,(H,25,30)(H,27,31,32)