8-azanyl-2-(3-phenylpropyl)purin-6-one

Systemtic Name: 8-azanyl-2-(3-phenylpropyl)purin-6-one Openeye Name: 8-amino-2-(3-phenylpropyl)purin-6-one CAS Name: 8-amino-2-(3-phenylpropyl)-6-purinone IUPAC Name: 8-amino-2-(3-phenylpropyl)purin-6-one Traditional Name: 8-amino-2-(3-phenylpropyl)purin-6-one Formula: C14H13N5O MolecularWeight: 267.28592

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCC2=NC(=O)C3=NC(=NC3=N2)N

Isomeric SMILES

C1=CC=C(C=C1)CCCC2=NC(=O)C3=NC(=NC3=N2)N

InChI

InChI=1S/C14H13N5O/c15-14-18-11-12(19-14)16-10(17-13(11)20)8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H2,15,16,17,19,20)