3-methyl-7-(2-methylprop-2-enyl)-8-methylsulfanyl-purine-2,6-dione

Systemtic Name: 3-methyl-7-(2-methylprop-2-enyl)-8-methylsulfanyl-purine-2,6-dione Openeye Name: 3-methyl-7-(2-methylallyl)-8-methylsulfanyl-purine-2,6-dione CAS Name: 3-methyl-7-(2-methylprop-2-enyl)-8-(methylthio)purine-2,6-dione IUPAC Name: 3-methyl-7-(2-methylprop-2-enyl)-8-methylsulfanylpurine-2,6-dione Traditional Name: 3-methyl-7-(2-methylallyl)-8-(methylthio)xanthine Formula: C11H14N4O2S MolecularWeight: 266.31946

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CN1C2=C(N=C1SC)N(C(=O)NC2=O)C

Isomeric SMILES

CC(=C)CN1C2=C(N=C1SC)N(C(=O)NC2=O)C

InChI

InChI=1S/C11H14N4O2S/c1-6(2)5-15-7-8(12-11(15)18-4)14(3)10(17)13-9(7)16/h1,5H2,2-4H3,(H,13,16,17)