3-[3,7-dibutyl-2,6-bis(oxidanylidene)purin-8-yl]-N-quinolin-5-yl-propanamide

Systemtic Name: 3-[3,7-dibutyl-2,6-bis(oxidanylidene)purin-8-yl]-N-quinolin-5-yl-propanamide Openeye Name: 3-(3,7-dibutyl-2,6-dioxo-purin-8-yl)-N-(5-quinolyl)propanamide CAS Name: 3-(3,7-dibutyl-2,6-dioxo-8-purinyl)-N-(5-quinolinyl)propanamide IUPAC Name: 3-(3,7-dibutyl-2,6-dioxopurin-8-yl)-N-quinolin-5-ylpropanamide Traditional Name: 3-(3,7-dibutyl-2,6-diketo-purin-8-yl)-N-(5-quinolyl)propionamide Formula: C25H30N6O3 MolecularWeight: 462.5441

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NC2=C1C(=O)NC(=O)N2CCCC)CCC(=O)NC3=CC=CC4=C3C=CC=N4

Isomeric SMILES

CCCCN1C(=NC2=C1C(=O)NC(=O)N2CCCC)CCC(=O)NC3=CC=CC4=C3C=CC=N4

InChI

InChI=1S/C25H30N6O3/c1-3-5-15-30-20(28-23-22(30)24(33)29-25(34)31(23)16-6-4-2)12-13-21(32)27-19-11-7-10-18-17(19)9-8-14-26-18/h7-11,14H,3-6,12-13,15-16H2,1-2H3,(H,27,32)(H,29,33,34)