1,3-dimethyl-7-pentyl-8-pyrrolidin-1-yl-purine-2,6-dione

Systemtic Name: 1,3-dimethyl-7-pentyl-8-pyrrolidin-1-yl-purine-2,6-dione Openeye Name: 1,3-dimethyl-7-pentyl-8-pyrrolidin-1-yl-purine-2,6-dione CAS Name: 1,3-dimethyl-7-pentyl-8-(1-pyrrolidinyl)purine-2,6-dione IUPAC Name: 1,3-dimethyl-7-pentyl-8-pyrrolidin-1-ylpurine-2,6-dione Traditional Name: 7-amyl-1,3-dimethyl-8-pyrrolidino-xanthine Formula: C16H25N5O2 MolecularWeight: 319.402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=C(N=C1N3CCCC3)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CCCCCN1C2=C(N=C1N3CCCC3)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C16H25N5O2/c1-4-5-6-11-21-12-13(17-15(21)20-9-7-8-10-20)18(2)16(23)19(3)14(12)22/h4-11H2,1-3H3