8-hexylsulfanyl-3,7-dihydropurin-6-one

Systemtic Name: 8-hexylsulfanyl-3,7-dihydropurin-6-one Openeye Name: 8-hexylsulfanyl-3,7-dihydropurin-6-one CAS Name: 8-(hexylthio)-3,7-dihydropurin-6-one IUPAC Name: 8-hexylsulfanyl-3,7-dihydropurin-6-one Traditional Name: 8-(hexylthio)-3,7-dihydropurin-6-one Formula: C11H16N4OS MolecularWeight: 252.33594

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=NC2=C(N1)C(=O)N=CN2

Isomeric SMILES

CCCCCCSC1=NC2=C(N1)C(=O)N=CN2

InChI

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