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

Systemtic Name: 8-butylsulfanyl-1,3-dimethyl-2-sulfanylidene-7H-purin-6-one Openeye Name: 8-butylsulfanyl-1,3-dimethyl-2-thioxo-7H-purin-6-one CAS Name: 8-(butylthio)-1,3-dimethyl-2-sulfanylidene-7H-purin-6-one IUPAC Name: 8-butylsulfanyl-1,3-dimethyl-2-sulfanylidene-7H-purin-6-one Traditional Name: 8-(butylthio)-1,3-dimethyl-2-thioxo-7H-purin-6-one Formula: C11H16N4OS2 MolecularWeight: 284.40094

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC2=C(N1)C(=O)N(C(=S)N2C)C

Isomeric SMILES

CCCCSC1=NC2=C(N1)C(=O)N(C(=S)N2C)C

InChI

InChI=1S/C11H16N4OS2/c1-4-5-6-18-10-12-7-8(13-10)14(2)11(17)15(3)9(7)16/h4-6H2,1-3H3,(H,12,13)