7-(2-hydroxyethyl)-1,3-dimethyl-8-phenylsulfanyl-purine-2,6-dione

Systemtic Name: 7-(2-hydroxyethyl)-1,3-dimethyl-8-phenylsulfanyl-purine-2,6-dione Openeye Name: 7-(2-hydroxyethyl)-1,3-dimethyl-8-phenylsulfanyl-purine-2,6-dione CAS Name: 7-(2-hydroxyethyl)-1,3-dimethyl-8-(phenylthio)purine-2,6-dione IUPAC Name: 7-(2-hydroxyethyl)-1,3-dimethyl-8-phenylsulfanylpurine-2,6-dione Traditional Name: 7-(2-hydroxyethyl)-1,3-dimethyl-8-(phenylthio)xanthine Formula: C15H16N4O3S MolecularWeight: 332.37754

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)SC3=CC=CC=C3)CCO

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)SC3=CC=CC=C3)CCO

InChI

InChI=1S/C15H16N4O3S/c1-17-12-11(13(21)18(2)15(17)22)19(8-9-20)14(16-12)23-10-6-4-3-5-7-10/h3-7,20H,8-9H2,1-2H3