2-azanyl-6-chloranyl-9-[(4-iodanyl-3,5-dimethyl-pyridin-2-yl)methyl]-7H-purin-8-one

Systemtic Name: 2-azanyl-6-chloranyl-9-[(4-iodanyl-3,5-dimethyl-pyridin-2-yl)methyl]-7H-purin-8-one Openeye Name: 2-amino-6-chloro-9-[(4-iodo-3,5-dimethyl-2-pyridyl)methyl]-7H-purin-8-one CAS Name: 2-amino-6-chloro-9-[(4-iodo-3,5-dimethyl-2-pyridinyl)methyl]-7H-purin-8-one IUPAC Name: 2-amino-6-chloro-9-[(4-iodo-3,5-dimethylpyridin-2-yl)methyl]-7H-purin-8-one Traditional Name: 2-amino-6-chloro-9-[(4-iodo-3,5-dimethyl-2-pyridyl)methyl]-7H-purin-8-one Formula: C13H12ClIN6O MolecularWeight: 430.63145

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C(=C1I)C)CN2C3=C(C(=NC(=N3)N)Cl)NC2=O

Isomeric SMILES

CC1=CN=C(C(=C1I)C)CN2C3=C(C(=NC(=N3)N)Cl)NC2=O

InChI

InChI=1S/C13H12ClIN6O/c1-5-3-17-7(6(2)8(5)15)4-21-11-9(18-13(21)22)10(14)19-12(16)20-11/h3H,4H2,1-2H3,(H,18,22)(H2,16,19,20)