3-[3-butyl-2,6-bis(oxidanylidene)-7-pentyl-purin-8-yl]-N-(2,3-dihydro-1H-inden-5-yl)propanamide

Systemtic Name: 3-[3-butyl-2,6-bis(oxidanylidene)-7-pentyl-purin-8-yl]-N-(2,3-dihydro-1H-inden-5-yl)propanamide Openeye Name: 3-(3-butyl-2,6-dioxo-7-pentyl-purin-8-yl)-N-indan-5-yl-propanamide CAS Name: 3-(3-butyl-2,6-dioxo-7-pentyl-8-purinyl)-N-(2,3-dihydro-1H-inden-5-yl)propanamide IUPAC Name: 3-(3-butyl-2,6-dioxo-7-pentylpurin-8-yl)-N-(2,3-dihydro-1H-inden-5-yl)propanamide Traditional Name: 3-(7-amyl-3-butyl-2,6-diketo-purin-8-yl)-N-indan-5-yl-propionamide Formula: C26H35N5O3 MolecularWeight: 465.5878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=NC2=C1C(=O)NC(=O)N2CCCC)CCC(=O)NC3=CC4=C(CCC4)C=C3

Isomeric SMILES

CCCCCN1C(=NC2=C1C(=O)NC(=O)N2CCCC)CCC(=O)NC3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C26H35N5O3/c1-3-5-7-16-30-21(28-24-23(30)25(33)29-26(34)31(24)15-6-4-2)13-14-22(32)27-20-12-11-18-9-8-10-19(18)17-20/h11-12,17H,3-10,13-16H2,1-2H3,(H,27,32)(H,29,33,34)