7-(2-methoxyethyl)-3-methyl-8-(2-methylprop-2-enylsulfanyl)purine-2,6-dione

Systemtic Name: 7-(2-methoxyethyl)-3-methyl-8-(2-methylprop-2-enylsulfanyl)purine-2,6-dione Openeye Name: 7-(2-methoxyethyl)-3-methyl-8-(2-methylallylsulfanyl)purine-2,6-dione CAS Name: 7-(2-methoxyethyl)-3-methyl-8-(2-methylprop-2-enylthio)purine-2,6-dione IUPAC Name: 7-(2-methoxyethyl)-3-methyl-8-(2-methylprop-2-enylsulfanyl)purine-2,6-dione Traditional Name: 7-(2-methoxyethyl)-3-methyl-8-(2-methylallylthio)xanthine Formula: C13H18N4O3S MolecularWeight: 310.37202

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CSC1=NC2=C(N1CCOC)C(=O)NC(=O)N2C

Isomeric SMILES

CC(=C)CSC1=NC2=C(N1CCOC)C(=O)NC(=O)N2C

InChI

InChI=1S/C13H18N4O3S/c1-8(2)7-21-13-14-10-9(17(13)5-6-20-4)11(18)15-12(19)16(10)3/h1,5-7H2,2-4H3,(H,15,18,19)