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

Systemtic Name: 7-hexyl-3-methyl-8-piperazin-1-yl-purine-2,6-dione Openeye Name: 7-hexyl-3-methyl-8-piperazin-1-yl-purine-2,6-dione CAS Name: 7-hexyl-3-methyl-8-(1-piperazinyl)purine-2,6-dione IUPAC Name: 7-hexyl-3-methyl-8-piperazin-1-ylpurine-2,6-dione Traditional Name: 7-hexyl-3-methyl-8-piperazino-xanthine Formula: C16H26N6O2 MolecularWeight: 334.41664

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=C(N=C1N3CCNCC3)N(C(=O)NC2=O)C

Isomeric SMILES

CCCCCCN1C2=C(N=C1N3CCNCC3)N(C(=O)NC2=O)C

InChI

InChI=1S/C16H26N6O2/c1-3-4-5-6-9-22-12-13(20(2)16(24)19-14(12)23)18-15(22)21-10-7-17-8-11-21/h17H,3-11H2,1-2H3,(H,19,23,24)