7-(2-ethoxyethyl)-8-[(4-ethylpiperazin-1-yl)methyl]-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 7-(2-ethoxyethyl)-8-[(4-ethylpiperazin-1-yl)methyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-(2-ethoxyethyl)-8-[(4-ethylpiperazin-1-yl)methyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 7-(2-ethoxyethyl)-8-[(4-ethyl-1-piperazinyl)methyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-(2-ethoxyethyl)-8-[(4-ethylpiperazin-1-yl)methyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 7-(2-ethoxyethyl)-8-[(4-ethylpiperazino)methyl]-1,3-dimethyl-xanthine Formula: C18H30N6O3 MolecularWeight: 378.4692

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CC2=NC3=C(N2CCOCC)C(=O)N(C(=O)N3C)C

Isomeric SMILES

CCN1CCN(CC1)CC2=NC3=C(N2CCOCC)C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C18H30N6O3/c1-5-22-7-9-23(10-8-22)13-14-19-16-15(24(14)11-12-27-6-2)17(25)21(4)18(26)20(16)3/h5-13H2,1-4H3