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9-butyl-7-chloranyl-3-methyl-6H-[1,2,4]triazolo[4,3-a]purin-5-one

9-butyl-7-chloranyl-3-methyl-6H-[1,2,4]triazolo[4,3-a]purin-5-one

Systemtic Name:9-butyl-7-chloranyl-3-methyl-6H-[1,2,4]triazolo[4,3-a]purin-5-one
Openeye Name:9-butyl-7-chloro-3-methyl-6H-[1,2,4]triazolo[4,3-a]purin-5-one
CAS Name:9-butyl-7-chloro-3-methyl-6H-[1,2,4]triazolo[4,3-a]purin-5-one
IUPAC Name:9-butyl-7-chloro-3-methyl-6H-[1,2,4]triazolo[4,3-a]purin-5-one
Traditional Name:9-butyl-7-chloro-3-methyl-6H-[1,2,4]triazolo[4,3-a]purin-5-one
Formula: C11H13ClN6O
MolecularWeight: 280.71352
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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=O)N3C1=NN=C3C)NC(=N2)Cl


Isomeric SMILES

CCCCN1C2=C(C(=O)N3C1=NN=C3C)NC(=N2)Cl


InChI

InChI=1S/C11H13ClN6O/c1-3-4-5-17-8-7(13-10(12)14-8)9(19)18-6(2)15-16-11(17)18/h3-5H2,1-2H3,(H,13,14)


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