2-(6-azanylpurin-7-yl)-1-phenyl-ethanone

Systemtic Name: 2-(6-azanylpurin-7-yl)-1-phenyl-ethanone Openeye Name: 2-(6-aminopurin-7-yl)-1-phenyl-ethanone CAS Name: 2-(6-amino-7-purinyl)-1-phenylethanone IUPAC Name: 2-(6-aminopurin-7-yl)-1-phenylethanone Traditional Name: 2-(6-aminopurin-7-yl)-1-phenyl-ethanone Formula: C13H11N5O MolecularWeight: 253.25934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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