8-(2-butoxyphenyl)-6-butyl-1H-[1,2,4]triazolo[3,4-f]purin-5-one

Systemtic Name: 8-(2-butoxyphenyl)-6-butyl-1H-[1,2,4]triazolo[3,4-f]purin-5-one Openeye Name: 8-(2-butoxyphenyl)-6-butyl-1H-[1,2,4]triazolo[3,4-f]purin-5-one CAS Name: 8-(2-butoxyphenyl)-6-butyl-1H-[1,2,4]triazolo[3,4-f]purin-5-one IUPAC Name: 8-(2-butoxyphenyl)-6-butyl-1H-[1,2,4]triazolo[3,4-f]purin-5-one Traditional Name: 8-(2-butoxyphenyl)-6-butyl-1H-[1,2,4]triazolo[3,4-f]purin-5-one Formula: C20H24N6O2 MolecularWeight: 380.44356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=NC(=NC2=C3NN=CN3C1=O)C4=CC=CC=C4OCCCC

Isomeric SMILES

CCCCN1C2=NC(=NC2=C3NN=CN3C1=O)C4=CC=CC=C4OCCCC

InChI

InChI=1S/C20H24N6O2/c1-3-5-11-25-18-16(19-24-21-13-26(19)20(25)27)22-17(23-18)14-9-7-8-10-15(14)28-12-6-4-2/h7-10,13,24H,3-6,11-12H2,1-2H3