8-dodecylsulfanyl-1,3-dimethyl-6-sulfanylidene-7H-purin-2-one

Systemtic Name: 8-dodecylsulfanyl-1,3-dimethyl-6-sulfanylidene-7H-purin-2-one Openeye Name: 8-dodecylsulfanyl-1,3-dimethyl-6-thioxo-7H-purin-2-one CAS Name: 8-(dodecylthio)-1,3-dimethyl-6-sulfanylidene-7H-purin-2-one IUPAC Name: 8-dodecylsulfanyl-1,3-dimethyl-6-sulfanylidene-7H-purin-2-one Traditional Name: 8-(laurylthio)-1,3-dimethyl-6-thioxo-7H-purin-2-one Formula: C19H32N4OS2 MolecularWeight: 396.61358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC1=NC2=C(N1)C(=S)N(C(=O)N2C)C

Isomeric SMILES

CCCCCCCCCCCCSC1=NC2=C(N1)C(=S)N(C(=O)N2C)C

InChI

InChI=1S/C19H32N4OS2/c1-4-5-6-7-8-9-10-11-12-13-14-26-18-20-15-16(21-18)22(2)19(24)23(3)17(15)25/h4-14H2,1-3H3,(H,20,21)