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

Systemtic Name: 8-[(4-ethylpiperazin-1-yl)methyl]-3-methyl-7-pentyl-purine-2,6-dione Openeye Name: 8-[(4-ethylpiperazin-1-yl)methyl]-3-methyl-7-pentyl-purine-2,6-dione CAS Name: 8-[(4-ethyl-1-piperazinyl)methyl]-3-methyl-7-pentylpurine-2,6-dione IUPAC Name: 8-[(4-ethylpiperazin-1-yl)methyl]-3-methyl-7-pentylpurine-2,6-dione Traditional Name: 7-amyl-8-[(4-ethylpiperazino)methyl]-3-methyl-xanthine Formula: C18H30N6O2 MolecularWeight: 362.4698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=NC2=C1C(=O)NC(=O)N2C)CN3CCN(CC3)CC

Isomeric SMILES

CCCCCN1C(=NC2=C1C(=O)NC(=O)N2C)CN3CCN(CC3)CC

InChI

InChI=1S/C18H30N6O2/c1-4-6-7-8-24-14(13-23-11-9-22(5-2)10-12-23)19-16-15(24)17(25)20-18(26)21(16)3/h4-13H2,1-3H3,(H,20,25,26)