7-[3-(azetidin-1-yl)-3-oxidanylidene-propyl]-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 7-[3-(azetidin-1-yl)-3-oxidanylidene-propyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-[3-(azetidin-1-yl)-3-oxo-propyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 7-[3-(1-azetidinyl)-3-oxopropyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-[3-(azetidin-1-yl)-3-oxopropyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 7-[3-(azetidin-1-yl)-3-keto-propyl]-1,3-dimethyl-xanthine Formula: C13H17N5O3 MolecularWeight: 291.30578

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCC(=O)N3CCC3

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCC(=O)N3CCC3

InChI

InChI=1S/C13H17N5O3/c1-15-11-10(12(20)16(2)13(15)21)18(8-14-11)7-4-9(19)17-5-3-6-17/h8H,3-7H2,1-2H3