7-[(E)-2-azanyl-2-morpholin-4-yl-ethenyl]-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 7-[(E)-2-azanyl-2-morpholin-4-yl-ethenyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-[(E)-2-amino-2-morpholino-vinyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 7-[(E)-2-amino-2-(4-morpholinyl)ethenyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-[(E)-2-amino-2-morpholin-4-ylethenyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 7-[(E)-2-amino-2-morpholino-vinyl]-1,3-dimethyl-xanthine Formula: C13H18N6O3 MolecularWeight: 306.32042

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)C=C(N)N3CCOCC3

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)/C=C(\N)/N3CCOCC3

InChI

InChI=1S/C13H18N6O3/c1-16-11-10(12(20)17(2)13(16)21)19(8-15-11)7-9(14)18-3-5-22-6-4-18/h7-8H,3-6,14H2,1-2H3/b9-7+