8-(3,3-dimethylbutylsulfanyl)-1,3-dimethyl-7H-purine-2,6-dione

Systemtic Name: 8-(3,3-dimethylbutylsulfanyl)-1,3-dimethyl-7H-purine-2,6-dione Openeye Name: 8-(3,3-dimethylbutylsulfanyl)-1,3-dimethyl-7H-purine-2,6-dione CAS Name: 8-(3,3-dimethylbutylthio)-1,3-dimethyl-7H-purine-2,6-dione IUPAC Name: 8-(3,3-dimethylbutylsulfanyl)-1,3-dimethyl-7H-purine-2,6-dione Traditional Name: 8-(3,3-dimethylbutylthio)-1,3-dimethyl-7H-purine-2,6-quinone Formula: C13H20N4O2S MolecularWeight: 296.3885

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CCSC1=NC2=C(N1)C(=O)N(C(=O)N2C)C

Isomeric SMILES

CC(C)(C)CCSC1=NC2=C(N1)C(=O)N(C(=O)N2C)C

InChI

InChI=1S/C13H20N4O2S/c1-13(2,3)6-7-20-11-14-8-9(15-11)16(4)12(19)17(5)10(8)18/h6-7H2,1-5H3,(H,14,15)