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

Systemtic Name: 8-cyclohexylsulfanyl-1,3-dimethyl-6-sulfanylidene-7H-purin-2-one Openeye Name: 8-cyclohexylsulfanyl-1,3-dimethyl-6-thioxo-7H-purin-2-one CAS Name: 8-(cyclohexylthio)-1,3-dimethyl-6-sulfanylidene-7H-purin-2-one IUPAC Name: 8-cyclohexylsulfanyl-1,3-dimethyl-6-sulfanylidene-7H-purin-2-one Traditional Name: 8-(cyclohexylthio)-1,3-dimethyl-6-thioxo-7H-purin-2-one Formula: C13H18N4OS2 MolecularWeight: 310.43822

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=S)N(C1=O)C)NC(=N2)SC3CCCCC3

Isomeric SMILES

CN1C2=C(C(=S)N(C1=O)C)NC(=N2)SC3CCCCC3

InChI

InChI=1S/C13H18N4OS2/c1-16-10-9(11(19)17(2)13(16)18)14-12(15-10)20-8-6-4-3-5-7-8/h8H,3-7H2,1-2H3,(H,14,15)