8-cyclopentylsulfanyl-1,3,7-trimethyl-purine-2,6-dione

Systemtic Name: 8-cyclopentylsulfanyl-1,3,7-trimethyl-purine-2,6-dione Openeye Name: 8-cyclopentylsulfanyl-1,3,7-trimethyl-purine-2,6-dione CAS Name: 8-(cyclopentylthio)-1,3,7-trimethylpurine-2,6-dione IUPAC Name: 8-cyclopentylsulfanyl-1,3,7-trimethylpurine-2,6-dione Traditional Name: 8-(cyclopentylthio)-1,3,7-trimethyl-xanthine Formula: C13H18N4O2S MolecularWeight: 294.37262

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(N=C1SC3CCCC3)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CN1C2=C(N=C1SC3CCCC3)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C13H18N4O2S/c1-15-9-10(16(2)13(19)17(3)11(9)18)14-12(15)20-8-6-4-5-7-8/h8H,4-7H2,1-3H3