8-bromanyl-3-methyl-6-pentyl-1H-[1,2,4]triazolo[3,4-f]purin-5-one

Systemtic Name: 8-bromanyl-3-methyl-6-pentyl-1H-[1,2,4]triazolo[3,4-f]purin-5-one Openeye Name: 8-bromo-3-methyl-6-pentyl-1H-[1,2,4]triazolo[3,4-f]purin-5-one CAS Name: 8-bromo-3-methyl-6-pentyl-1H-[1,2,4]triazolo[3,4-f]purin-5-one IUPAC Name: 8-bromo-3-methyl-6-pentyl-1H-[1,2,4]triazolo[3,4-f]purin-5-one Traditional Name: 6-amyl-8-bromo-3-methyl-1H-[1,2,4]triazolo[3,4-f]purin-5-one Formula: C12H15BrN6O MolecularWeight: 339.1911

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=NC(=NC2=C3NN=C(N3C1=O)C)Br

Isomeric SMILES

CCCCCN1C2=NC(=NC2=C3NN=C(N3C1=O)C)Br

InChI

InChI=1S/C12H15BrN6O/c1-3-4-5-6-18-9-8(14-11(13)15-9)10-17-16-7(2)19(10)12(18)20/h17H,3-6H2,1-2H3