7-heptyl-3-methyl-8-(4-methylpiperazin-1-yl)purine-2,6-dione

Systemtic Name: 7-heptyl-3-methyl-8-(4-methylpiperazin-1-yl)purine-2,6-dione Openeye Name: 7-heptyl-3-methyl-8-(4-methylpiperazin-1-yl)purine-2,6-dione CAS Name: 7-heptyl-3-methyl-8-(4-methyl-1-piperazinyl)purine-2,6-dione IUPAC Name: 7-heptyl-3-methyl-8-(4-methylpiperazin-1-yl)purine-2,6-dione Traditional Name: 7-heptyl-3-methyl-8-(4-methylpiperazino)xanthine Formula: C18H30N6O2 MolecularWeight: 362.4698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C2=C(N=C1N3CCN(CC3)C)N(C(=O)NC2=O)C

Isomeric SMILES

CCCCCCCN1C2=C(N=C1N3CCN(CC3)C)N(C(=O)NC2=O)C

InChI

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