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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C(=O)N=C2N)NC=N3

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C(=O)N=C2N)NC=N3

InChI

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