3-[7-butyl-2,6-bis(oxidanylidene)-3-propyl-purin-8-yl]-N-(2-tert-butylphenyl)propanamide

Systemtic Name: 3-[7-butyl-2,6-bis(oxidanylidene)-3-propyl-purin-8-yl]-N-(2-tert-butylphenyl)propanamide Openeye Name: 3-(7-butyl-2,6-dioxo-3-propyl-purin-8-yl)-N-(2-tert-butylphenyl)propanamide CAS Name: 3-(7-butyl-2,6-dioxo-3-propyl-8-purinyl)-N-(2-tert-butylphenyl)propanamide IUPAC Name: 3-(7-butyl-2,6-dioxo-3-propylpurin-8-yl)-N-(2-tert-butylphenyl)propanamide Traditional Name: 3-(7-butyl-2,6-diketo-3-propyl-purin-8-yl)-N-(2-tert-butylphenyl)propionamide Formula: C25H35N5O3 MolecularWeight: 453.5771

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NC2=C1C(=O)NC(=O)N2CCC)CCC(=O)NC3=CC=CC=C3C(C)(C)C

Isomeric SMILES

CCCCN1C(=NC2=C1C(=O)NC(=O)N2CCC)CCC(=O)NC3=CC=CC=C3C(C)(C)C

InChI

InChI=1S/C25H35N5O3/c1-6-8-16-29-19(27-22-21(29)23(32)28-24(33)30(22)15-7-2)13-14-20(31)26-18-12-10-9-11-17(18)25(3,4)5/h9-12H,6-8,13-16H2,1-5H3,(H,26,31)(H,28,32,33)