3-[3,7-dibutyl-2,6-bis(oxidanylidene)purin-8-yl]-N-(2-propan-2-ylphenyl)propanamide

Systemtic Name: 3-[3,7-dibutyl-2,6-bis(oxidanylidene)purin-8-yl]-N-(2-propan-2-ylphenyl)propanamide Openeye Name: 3-(3,7-dibutyl-2,6-dioxo-purin-8-yl)-N-(2-isopropylphenyl)propanamide CAS Name: 3-(3,7-dibutyl-2,6-dioxo-8-purinyl)-N-(2-propan-2-ylphenyl)propanamide IUPAC Name: 3-(3,7-dibutyl-2,6-dioxopurin-8-yl)-N-(2-propan-2-ylphenyl)propanamide Traditional Name: 3-(3,7-dibutyl-2,6-diketo-purin-8-yl)-N-o-cumenyl-propionamide Formula: C25H35N5O3 MolecularWeight: 453.5771

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NC2=C1C(=O)NC(=O)N2CCCC)CCC(=O)NC3=CC=CC=C3C(C)C

Isomeric SMILES

CCCCN1C(=NC2=C1C(=O)NC(=O)N2CCCC)CCC(=O)NC3=CC=CC=C3C(C)C

InChI

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