1,3-dimethyl-7-(2-methylpropyl)-8-piperidin-1-yl-purine-2,6-dione

Systemtic Name: 1,3-dimethyl-7-(2-methylpropyl)-8-piperidin-1-yl-purine-2,6-dione Openeye Name: 7-isobutyl-1,3-dimethyl-8-(1-piperidyl)purine-2,6-dione CAS Name: 1,3-dimethyl-7-(2-methylpropyl)-8-(1-piperidinyl)purine-2,6-dione IUPAC Name: 1,3-dimethyl-7-(2-methylpropyl)-8-piperidin-1-ylpurine-2,6-dione Traditional Name: 7-isobutyl-1,3-dimethyl-8-piperidino-xanthine Formula: C16H25N5O2 MolecularWeight: 319.402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(N=C1N3CCCCC3)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CC(C)CN1C2=C(N=C1N3CCCCC3)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C16H25N5O2/c1-11(2)10-21-12-13(18(3)16(23)19(4)14(12)22)17-15(21)20-8-6-5-7-9-20/h11H,5-10H2,1-4H3