8-decylsulfanyl-1,3-dimethyl-7H-purine-2,6-dione

Systemtic Name: 8-decylsulfanyl-1,3-dimethyl-7H-purine-2,6-dione Openeye Name: 8-decylsulfanyl-1,3-dimethyl-7H-purine-2,6-dione CAS Name: 8-(decylthio)-1,3-dimethyl-7H-purine-2,6-dione IUPAC Name: 8-decylsulfanyl-1,3-dimethyl-7H-purine-2,6-dione Traditional Name: 8-(decylthio)-1,3-dimethyl-7H-purine-2,6-quinone Formula: C17H28N4O2S MolecularWeight: 352.49482

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCSC1=NC2=C(N1)C(=O)N(C(=O)N2C)C

Isomeric SMILES

CCCCCCCCCCSC1=NC2=C(N1)C(=O)N(C(=O)N2C)C

InChI

InChI=1S/C17H28N4O2S/c1-4-5-6-7-8-9-10-11-12-24-16-18-13-14(19-16)20(2)17(23)21(3)15(13)22/h4-12H2,1-3H3,(H,18,19)