7-(2-methoxyethyl)-3-methyl-8-propan-2-ylsulfanyl-purine-2,6-dione

Systemtic Name: 7-(2-methoxyethyl)-3-methyl-8-propan-2-ylsulfanyl-purine-2,6-dione Openeye Name: 8-isopropylsulfanyl-7-(2-methoxyethyl)-3-methyl-purine-2,6-dione CAS Name: 7-(2-methoxyethyl)-3-methyl-8-(propan-2-ylthio)purine-2,6-dione IUPAC Name: 7-(2-methoxyethyl)-3-methyl-8-propan-2-ylsulfanylpurine-2,6-dione Traditional Name: 8-(isopropylthio)-7-(2-methoxyethyl)-3-methyl-xanthine Formula: C12H18N4O3S MolecularWeight: 298.36132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NC2=C(N1CCOC)C(=O)NC(=O)N2C

Isomeric SMILES

CC(C)SC1=NC2=C(N1CCOC)C(=O)NC(=O)N2C

InChI

InChI=1S/C12H18N4O3S/c1-7(2)20-12-13-9-8(16(12)5-6-19-4)10(17)14-11(18)15(9)3/h7H,5-6H2,1-4H3,(H,14,17,18)