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

Systemtic Name: 1,3,7-trimethyl-8-undecylsulfanyl-purine-2,6-dione Openeye Name: 1,3,7-trimethyl-8-undecylsulfanyl-purine-2,6-dione CAS Name: 1,3,7-trimethyl-8-(undecylthio)purine-2,6-dione IUPAC Name: 1,3,7-trimethyl-8-undecylsulfanylpurine-2,6-dione Traditional Name: 1,3,7-trimethyl-8-(undecylthio)xanthine Formula: C19H32N4O2S MolecularWeight: 380.54798

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCSC1=NC2=C(N1C)C(=O)N(C(=O)N2C)C

Isomeric SMILES

CCCCCCCCCCCSC1=NC2=C(N1C)C(=O)N(C(=O)N2C)C

InChI

InChI=1S/C19H32N4O2S/c1-5-6-7-8-9-10-11-12-13-14-26-18-20-16-15(21(18)2)17(24)23(4)19(25)22(16)3/h5-14H2,1-4H3