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

Systemtic Name: 3-[3-butyl-7-(2-methylpropyl)-2,6-bis(oxidanylidene)purin-8-yl]-N-(3-cyclohexylpropyl)propanamide Openeye Name: 3-(3-butyl-7-isobutyl-2,6-dioxo-purin-8-yl)-N-(3-cyclohexylpropyl)propanamide CAS Name: 3-[3-butyl-7-(2-methylpropyl)-2,6-dioxo-8-purinyl]-N-(3-cyclohexylpropyl)propanamide IUPAC Name: 3-[3-butyl-7-(2-methylpropyl)-2,6-dioxopurin-8-yl]-N-(3-cyclohexylpropyl)propanamide Traditional Name: 3-(3-butyl-7-isobutyl-2,6-diketo-purin-8-yl)-N-(3-cyclohexylpropyl)propionamide Formula: C25H41N5O3 MolecularWeight: 459.62474

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=O)NC1=O)N(C(=N2)CCC(=O)NCCCC3CCCCC3)CC(C)C

Isomeric SMILES

CCCCN1C2=C(C(=O)NC1=O)N(C(=N2)CCC(=O)NCCCC3CCCCC3)CC(C)C

InChI

InChI=1S/C25H41N5O3/c1-4-5-16-29-23-22(24(32)28-25(29)33)30(17-18(2)3)20(27-23)13-14-21(31)26-15-9-12-19-10-7-6-8-11-19/h18-19H,4-17H2,1-3H3,(H,26,31)(H,28,32,33)