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

Systemtic Name: 6-butyl-8-(2-propoxyphenyl)-1H-[1,2,4]triazolo[3,4-f]purin-5-one Openeye Name: 6-butyl-8-(2-propoxyphenyl)-1H-[1,2,4]triazolo[3,4-f]purin-5-one CAS Name: 6-butyl-8-(2-propoxyphenyl)-1H-[1,2,4]triazolo[3,4-f]purin-5-one IUPAC Name: 6-butyl-8-(2-propoxyphenyl)-1H-[1,2,4]triazolo[3,4-f]purin-5-one Traditional Name: 6-butyl-8-(2-propoxyphenyl)-1H-[1,2,4]triazolo[3,4-f]purin-5-one Formula: C19H22N6O2 MolecularWeight: 366.41698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=NC(=NC2=C3NN=CN3C1=O)C4=CC=CC=C4OCCC

Isomeric SMILES

CCCCN1C2=NC(=NC2=C3NN=CN3C1=O)C4=CC=CC=C4OCCC

InChI

InChI=1S/C19H22N6O2/c1-3-5-10-24-17-15(18-23-20-12-25(18)19(24)26)21-16(22-17)13-8-6-7-9-14(13)27-11-4-2/h6-9,12,23H,3-5,10-11H2,1-2H3