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8-ethylsulfanyl-1,3,7-trimethyl-purine-2,6-dione

8-ethylsulfanyl-1,3,7-trimethyl-purine-2,6-dione

Systemtic Name:8-ethylsulfanyl-1,3,7-trimethyl-purine-2,6-dione
Openeye Name:8-ethylsulfanyl-1,3,7-trimethyl-purine-2,6-dione
CAS Name:8-(ethylthio)-1,3,7-trimethylpurine-2,6-dione
IUPAC Name:8-ethylsulfanyl-1,3,7-trimethylpurine-2,6-dione
Traditional Name:8-(ethylthio)-1,3,7-trimethyl-xanthine
Formula: C10H14N4O2S
MolecularWeight: 254.30876
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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=C(N1C)C(=O)N(C(=O)N2C)C


Isomeric SMILES

CCSC1=NC2=C(N1C)C(=O)N(C(=O)N2C)C


InChI

InChI=1S/C10H14N4O2S/c1-5-17-9-11-7-6(12(9)2)8(15)14(4)10(16)13(7)3/h5H2,1-4H3


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