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

Systemtic Name: N-(1H-benzimidazol-2-yl)-3-[3-butyl-2,6-bis(oxidanylidene)-7-pentyl-purin-8-yl]propanamide Openeye Name: N-(1H-benzimidazol-2-yl)-3-(3-butyl-2,6-dioxo-7-pentyl-purin-8-yl)propanamide CAS Name: N-(1H-benzimidazol-2-yl)-3-(3-butyl-2,6-dioxo-7-pentyl-8-purinyl)propanamide IUPAC Name: N-(1H-benzimidazol-2-yl)-3-(3-butyl-2,6-dioxo-7-pentylpurin-8-yl)propanamide Traditional Name: 3-(7-amyl-3-butyl-2,6-diketo-purin-8-yl)-N-(1H-benzimidazol-2-yl)propionamide Formula: C24H31N7O3 MolecularWeight: 465.54804

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=NC2=C1C(=O)NC(=O)N2CCCC)CCC(=O)NC3=NC4=CC=CC=C4N3

Isomeric SMILES

CCCCCN1C(=NC2=C1C(=O)NC(=O)N2CCCC)CCC(=O)NC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C24H31N7O3/c1-3-5-9-15-30-18(27-21-20(30)22(33)29-24(34)31(21)14-6-4-2)12-13-19(32)28-23-25-16-10-7-8-11-17(16)26-23/h7-8,10-11H,3-6,9,12-15H2,1-2H3,(H,29,33,34)(H2,25,26,28,32)