6-butylsulfanyl-1,3-dimethyl-purin-2-one

Systemtic Name: 6-butylsulfanyl-1,3-dimethyl-purin-2-one Openeye Name: 6-butylsulfanyl-1,3-dimethyl-purin-2-one CAS Name: 6-(butylthio)-1,3-dimethyl-2-purinone IUPAC Name: 6-butylsulfanyl-1,3-dimethylpurin-2-one Traditional Name: 6-(butylthio)-1,3-dimethyl-purin-2-one Formula: C11H16N4OS MolecularWeight: 252.33594

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=C2C(=NC=N2)N(C(=O)N1C)C

Isomeric SMILES

CCCCSC1=C2C(=NC=N2)N(C(=O)N1C)C

InChI

InChI=1S/C11H16N4OS/c1-4-5-6-17-10-8-9(13-7-12-8)14(2)11(16)15(10)3/h7H,4-6H2,1-3H3