8-ethylsulfanyl-3-methyl-7-propyl-purine-2,6-dione

Systemtic Name: 8-ethylsulfanyl-3-methyl-7-propyl-purine-2,6-dione Openeye Name: 8-ethylsulfanyl-3-methyl-7-propyl-purine-2,6-dione CAS Name: 8-(ethylthio)-3-methyl-7-propylpurine-2,6-dione IUPAC Name: 8-ethylsulfanyl-3-methyl-7-propylpurine-2,6-dione Traditional Name: 8-(ethylthio)-3-methyl-7-propyl-xanthine Formula: C11H16N4O2S MolecularWeight: 268.33534

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(N=C1SCC)N(C(=O)NC2=O)C

Isomeric SMILES

CCCN1C2=C(N=C1SCC)N(C(=O)NC2=O)C

InChI

InChI=1S/C11H16N4O2S/c1-4-6-15-7-8(12-11(15)18-5-2)14(3)10(17)13-9(7)16/h4-6H2,1-3H3,(H,13,16,17)