6-azanyl-2-butoxy-9-[(6-chloranylpyridin-3-yl)methyl]-7H-purin-8-one

Systemtic Name: 6-azanyl-2-butoxy-9-[(6-chloranylpyridin-3-yl)methyl]-7H-purin-8-one Openeye Name: 6-amino-2-butoxy-9-[(6-chloro-3-pyridyl)methyl]-7H-purin-8-one CAS Name: 6-amino-2-butoxy-9-[(6-chloro-3-pyridinyl)methyl]-7H-purin-8-one IUPAC Name: 6-amino-2-butoxy-9-[(6-chloropyridin-3-yl)methyl]-7H-purin-8-one Traditional Name: 6-amino-2-butoxy-9-[(6-chloro-3-pyridyl)methyl]-7H-purin-8-one Formula: C15H17ClN6O2 MolecularWeight: 348.78748

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NC2=C(C(=N1)N)NC(=O)N2CC3=CN=C(C=C3)Cl

Isomeric SMILES

CCCCOC1=NC2=C(C(=N1)N)NC(=O)N2CC3=CN=C(C=C3)Cl

InChI

InChI=1S/C15H17ClN6O2/c1-2-3-6-24-14-20-12(17)11-13(21-14)22(15(23)19-11)8-9-4-5-10(16)18-7-9/h4-5,7H,2-3,6,8H2,1H3,(H,19,23)(H2,17,20,21)