7-heptyl-3-methyl-8-piperazin-1-yl-purine-2,6-dione

Systemtic Name: 7-heptyl-3-methyl-8-piperazin-1-yl-purine-2,6-dione Openeye Name: 7-heptyl-3-methyl-8-piperazin-1-yl-purine-2,6-dione CAS Name: 7-heptyl-3-methyl-8-(1-piperazinyl)purine-2,6-dione IUPAC Name: 7-heptyl-3-methyl-8-piperazin-1-ylpurine-2,6-dione Traditional Name: 7-heptyl-3-methyl-8-piperazino-xanthine Formula: C17H28N6O2 MolecularWeight: 348.44322

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C2=C(N=C1N3CCNCC3)N(C(=O)NC2=O)C

Isomeric SMILES

CCCCCCCN1C2=C(N=C1N3CCNCC3)N(C(=O)NC2=O)C

InChI

InChI=1S/C17H28N6O2/c1-3-4-5-6-7-10-23-13-14(21(2)17(25)20-15(13)24)19-16(23)22-11-8-18-9-12-22/h18H,3-12H2,1-2H3,(H,20,24,25)