2-azanyl-8-bromanyl-9-[(3-chlorophenyl)methyl]-7,8-dihydro-3H-purin-6-one

Systemtic Name: 2-azanyl-8-bromanyl-9-[(3-chlorophenyl)methyl]-7,8-dihydro-3H-purin-6-one Openeye Name: 2-amino-8-bromo-9-[(3-chlorophenyl)methyl]-7,8-dihydro-3H-purin-6-one CAS Name: 2-amino-8-bromo-9-[(3-chlorophenyl)methyl]-7,8-dihydro-3H-purin-6-one IUPAC Name: 2-amino-8-bromo-9-[(3-chlorophenyl)methyl]-7,8-dihydro-3H-purin-6-one Traditional Name: 2-amino-8-bromo-9-(3-chlorobenzyl)-7,8-dihydro-3H-purin-6-one Formula: C12H11BrClN5O MolecularWeight: 356.60564

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)CN2C(NC3=C2NC(=NC3=O)N)Br

Isomeric SMILES

C1=CC(=CC(=C1)Cl)CN2C(NC3=C2NC(=NC3=O)N)Br

InChI

InChI=1S/C12H11BrClN5O/c13-11-16-8-9(17-12(15)18-10(8)20)19(11)5-6-2-1-3-7(14)4-6/h1-4,11,16H,5H2,(H3,15,17,18,20)