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

Systemtic Name: 3-[3-butyl-7-(2-methylpropyl)-2,6-bis(oxidanylidene)purin-8-yl]-N-cyclohexyl-N-ethyl-propanamide Openeye Name: 3-(3-butyl-7-isobutyl-2,6-dioxo-purin-8-yl)-N-cyclohexyl-N-ethyl-propanamide CAS Name: 3-[3-butyl-7-(2-methylpropyl)-2,6-dioxo-8-purinyl]-N-cyclohexyl-N-ethylpropanamide IUPAC Name: 3-[3-butyl-7-(2-methylpropyl)-2,6-dioxopurin-8-yl]-N-cyclohexyl-N-ethylpropanamide Traditional Name: 3-(3-butyl-7-isobutyl-2,6-diketo-purin-8-yl)-N-cyclohexyl-N-ethyl-propionamide Formula: C24H39N5O3 MolecularWeight: 445.59816

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=O)NC1=O)N(C(=N2)CCC(=O)N(CC)C3CCCCC3)CC(C)C

Isomeric SMILES

CCCCN1C2=C(C(=O)NC1=O)N(C(=N2)CCC(=O)N(CC)C3CCCCC3)CC(C)C

InChI

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