2-azanyl-9-[(3,4-dichlorophenyl)methyl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[(3,4-dichlorophenyl)methyl]-3H-purin-6-one Openeye Name: 2-amino-9-[(3,4-dichlorophenyl)methyl]-3H-purin-6-one CAS Name: 2-amino-9-[(3,4-dichlorophenyl)methyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[(3,4-dichlorophenyl)methyl]-3H-purin-6-one Traditional Name: 2-amino-9-(3,4-dichlorobenzyl)-3H-purin-6-one Formula: C12H9Cl2N5O MolecularWeight: 310.13876

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CN2C=NC3=C2NC(=NC3=O)N)Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1CN2C=NC3=C2NC(=NC3=O)N)Cl)Cl

InChI

InChI=1S/C12H9Cl2N5O/c13-7-2-1-6(3-8(7)14)4-19-5-16-9-10(19)17-12(15)18-11(9)20/h1-3,5H,4H2,(H3,15,17,18,20)