2-butoxy-9-[(6-chloranylpyridin-3-yl)methyl]purin-6-amine

Systemtic Name: 2-butoxy-9-[(6-chloranylpyridin-3-yl)methyl]purin-6-amine Openeye Name: 2-butoxy-9-[(6-chloro-3-pyridyl)methyl]purin-6-amine CAS Name: 2-butoxy-9-[(6-chloro-3-pyridinyl)methyl]-6-purinamine IUPAC Name: 2-butoxy-9-[(6-chloropyridin-3-yl)methyl]purin-6-amine Traditional Name: [2-butoxy-9-[(6-chloro-3-pyridyl)methyl]purin-6-yl]amine Formula: C15H17ClN6O MolecularWeight: 332.78808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NC2=C(C(=N1)N)N=CN2CC3=CN=C(C=C3)Cl

Isomeric SMILES

CCCCOC1=NC2=C(C(=N1)N)N=CN2CC3=CN=C(C=C3)Cl

InChI

InChI=1S/C15H17ClN6O/c1-2-3-6-23-15-20-13(17)12-14(21-15)22(9-19-12)8-10-4-5-11(16)18-7-10/h4-5,7,9H,2-3,6,8H2,1H3,(H2,17,20,21)