6-azanyl-2-(azetidin-1-ylcarbonyl)-9-(phenylmethyl)-7H-purin-8-one

Systemtic Name: 6-azanyl-2-(azetidin-1-ylcarbonyl)-9-(phenylmethyl)-7H-purin-8-one Openeye Name: 6-amino-2-(azetidine-1-carbonyl)-9-benzyl-7H-purin-8-one CAS Name: 6-amino-2-[1-azetidinyl(oxo)methyl]-9-(phenylmethyl)-7H-purin-8-one IUPAC Name: 6-amino-2-(azetidine-1-carbonyl)-9-benzyl-7H-purin-8-one Traditional Name: 6-amino-2-(azetidine-1-carbonyl)-9-benzyl-7H-purin-8-one Formula: C16H16N6O2 MolecularWeight: 324.33724

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C1)C(=O)C2=NC3=C(C(=N2)N)NC(=O)N3CC4=CC=CC=C4

Isomeric SMILES

C1CN(C1)C(=O)C2=NC3=C(C(=N2)N)NC(=O)N3CC4=CC=CC=C4

InChI

InChI=1S/C16H16N6O2/c17-12-11-14(20-13(19-12)15(23)21-7-4-8-21)22(16(24)18-11)9-10-5-2-1-3-6-10/h1-3,5-6H,4,7-9H2,(H,18,24)(H2,17,19,20)