8-(2-dimethylaminoethylsulfanyl)-1,3,9-trimethyl-purine-2,6-dione

Systemtic Name: 8-(2-dimethylaminoethylsulfanyl)-1,3,9-trimethyl-purine-2,6-dione Openeye Name: 8-(2-dimethylaminoethylsulfanyl)-1,3,9-trimethyl-purine-2,6-dione CAS Name: 8-(2-dimethylaminoethylthio)-1,3,9-trimethylpurine-2,6-dione IUPAC Name: 8-(2-dimethylaminoethylsulfanyl)-1,3,9-trimethylpurine-2,6-dione Traditional Name: 8-(2-dimethylaminoethylthio)-1,3,9-trimethyl-xanthine Formula: C12H19N5O2S MolecularWeight: 297.37656

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C(=O)N2C)C)N=C1SCCN(C)C

Isomeric SMILES

CN1C2=C(C(=O)N(C(=O)N2C)C)N=C1SCCN(C)C

InChI

InChI=1S/C12H19N5O2S/c1-14(2)6-7-20-11-13-8-9(15(11)3)16(4)12(19)17(5)10(8)18/h6-7H2,1-5H3