8-(2-dimethylaminoethylsulfanyl)-1,3,7-trimethyl-purine-2,6-dione

Systemtic Name: 8-(2-dimethylaminoethylsulfanyl)-1,3,7-trimethyl-purine-2,6-dione Openeye Name: 8-(2-dimethylaminoethylsulfanyl)-1,3,7-trimethyl-purine-2,6-dione CAS Name: 8-(2-dimethylaminoethylthio)-1,3,7-trimethylpurine-2,6-dione IUPAC Name: 8-(2-dimethylaminoethylsulfanyl)-1,3,7-trimethylpurine-2,6-dione Traditional Name: 8-(2-dimethylaminoethylthio)-1,3,7-trimethyl-xanthine Formula: C12H19N5O2S MolecularWeight: 297.37656

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(N=C1SCCN(C)C)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CN1C2=C(N=C1SCCN(C)C)N(C(=O)N(C2=O)C)C

InChI

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