2-chloranyl-8-methyl-4-pentyl-7H-[1,2,4]triazolo[5,1-f]purin-5-one

Systemtic Name: 2-chloranyl-8-methyl-4-pentyl-7H-[1,2,4]triazolo[5,1-f]purin-5-one Openeye Name: 2-chloro-8-methyl-4-pentyl-7H-[1,2,4]triazolo[5,1-f]purin-5-one CAS Name: 2-chloro-8-methyl-4-pentyl-7H-[1,2,4]triazolo[5,1-f]purin-5-one IUPAC Name: 2-chloro-8-methyl-4-pentyl-7H-[1,2,4]triazolo[5,1-f]purin-5-one Traditional Name: 4-amyl-2-chloro-8-methyl-7H-[1,2,4]triazolo[5,1-f]purin-5-one Formula: C12H15ClN6O MolecularWeight: 294.7401

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=NC(=NC2=C3N=C(NN3C1=O)C)Cl

Isomeric SMILES

CCCCCN1C2=NC(=NC2=C3N=C(NN3C1=O)C)Cl

InChI

InChI=1S/C12H15ClN6O/c1-3-4-5-6-18-9-8(15-11(13)16-9)10-14-7(2)17-19(10)12(18)20/h3-6H2,1-2H3,(H,14,17)