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7-butyl-3-methyl-8-nonylsulfanyl-purine-2,6-dione

7-butyl-3-methyl-8-nonylsulfanyl-purine-2,6-dione

Systemtic Name:7-butyl-3-methyl-8-nonylsulfanyl-purine-2,6-dione
Openeye Name:7-butyl-3-methyl-8-nonylsulfanyl-purine-2,6-dione
CAS Name:7-butyl-3-methyl-8-(nonylthio)purine-2,6-dione
IUPAC Name:7-butyl-3-methyl-8-nonylsulfanylpurine-2,6-dione
Traditional Name:7-butyl-3-methyl-8-(nonylthio)xanthine
Formula: C19H32N4O2S
MolecularWeight: 380.54798
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCSC1=NC2=C(N1CCCC)C(=O)NC(=O)N2C


Isomeric SMILES

CCCCCCCCCSC1=NC2=C(N1CCCC)C(=O)NC(=O)N2C


InChI

InChI=1S/C19H32N4O2S/c1-4-6-8-9-10-11-12-14-26-19-20-16-15(23(19)13-7-5-2)17(24)21-18(25)22(16)3/h4-14H2,1-3H3,(H,21,24,25)


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