8-azanyl-2-phenethyl-purin-6-one

Systemtic Name: 8-azanyl-2-phenethyl-purin-6-one Openeye Name: 8-amino-2-phenethyl-purin-6-one CAS Name: 8-amino-2-phenethyl-6-purinone IUPAC Name: 8-amino-2-phenethylpurin-6-one Traditional Name: 8-amino-2-phenethyl-purin-6-one Formula: C13H11N5O MolecularWeight: 253.25934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=NC(=O)C3=NC(=NC3=N2)N

Isomeric SMILES

C1=CC=C(C=C1)CCC2=NC(=O)C3=NC(=NC3=N2)N

InChI

InChI=1S/C13H11N5O/c14-13-17-10-11(18-13)15-9(16-12(10)19)7-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H2,14,15,16,18,19)