2-azanyl-7-(phenylmethyl)-3H-purin-6-one

Systemtic Name: 2-azanyl-7-(phenylmethyl)-3H-purin-6-one Openeye Name: 2-amino-7-benzyl-3H-purin-6-one CAS Name: 2-amino-7-(phenylmethyl)-3H-purin-6-one IUPAC Name: 2-amino-7-benzyl-3H-purin-6-one Traditional Name: 2-amino-7-benzyl-3H-purin-6-one Formula: C12H11N5O MolecularWeight: 241.24864

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=NC3=C2C(=O)N=C(N3)N

Isomeric SMILES

C1=CC=C(C=C1)CN2C=NC3=C2C(=O)N=C(N3)N

InChI

InChI=1S/C12H11N5O/c13-12-15-10-9(11(18)16-12)17(7-14-10)6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H3,13,15,16,18)