3-[3-butyl-2,6-bis(oxidanylidene)-7-pentyl-purin-8-yl]-N-[(3-fluorophenyl)methyl]propanamide

Systemtic Name: 3-[3-butyl-2,6-bis(oxidanylidene)-7-pentyl-purin-8-yl]-N-[(3-fluorophenyl)methyl]propanamide Openeye Name: 3-(3-butyl-2,6-dioxo-7-pentyl-purin-8-yl)-N-[(3-fluorophenyl)methyl]propanamide CAS Name: 3-(3-butyl-2,6-dioxo-7-pentyl-8-purinyl)-N-[(3-fluorophenyl)methyl]propanamide IUPAC Name: 3-(3-butyl-2,6-dioxo-7-pentylpurin-8-yl)-N-[(3-fluorophenyl)methyl]propanamide Traditional Name: 3-(7-amyl-3-butyl-2,6-diketo-purin-8-yl)-N-(3-fluorobenzyl)propionamide Formula: C24H32FN5O3 MolecularWeight: 457.540983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=NC2=C1C(=O)NC(=O)N2CCCC)CCC(=O)NCC3=CC(=CC=C3)F

Isomeric SMILES

CCCCCN1C(=NC2=C1C(=O)NC(=O)N2CCCC)CCC(=O)NCC3=CC(=CC=C3)F

InChI

InChI=1S/C24H32FN5O3/c1-3-5-7-14-29-19(11-12-20(31)26-16-17-9-8-10-18(25)15-17)27-22-21(29)23(32)28-24(33)30(22)13-6-4-2/h8-10,15H,3-7,11-14,16H2,1-2H3,(H,26,31)(H,28,32,33)