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

Systemtic Name: 8-bromanyl-6-butyl-3-methyl-1H-[1,2,4]triazolo[3,4-f]purin-5-one Openeye Name: 8-bromo-6-butyl-3-methyl-1H-[1,2,4]triazolo[3,4-f]purin-5-one CAS Name: 8-bromo-6-butyl-3-methyl-1H-[1,2,4]triazolo[3,4-f]purin-5-one IUPAC Name: 8-bromo-6-butyl-3-methyl-1H-[1,2,4]triazolo[3,4-f]purin-5-one Traditional Name: 8-bromo-6-butyl-3-methyl-1H-[1,2,4]triazolo[3,4-f]purin-5-one Formula: C11H13BrN6O MolecularWeight: 325.16452

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=NC(=NC2=C3NN=C(N3C1=O)C)Br

Isomeric SMILES

CCCCN1C2=NC(=NC2=C3NN=C(N3C1=O)C)Br

InChI

InChI=1S/C11H13BrN6O/c1-3-4-5-17-8-7(13-10(12)14-8)9-16-15-6(2)18(9)11(17)19/h16H,3-5H2,1-2H3