8-cyclohexyl-6-methylsulfanyl-3-propyl-7H-purin-2-one

Systemtic Name: 8-cyclohexyl-6-methylsulfanyl-3-propyl-7H-purin-2-one Openeye Name: 8-cyclohexyl-6-methylsulfanyl-3-propyl-7H-purin-2-one CAS Name: 8-cyclohexyl-6-(methylthio)-3-propyl-7H-purin-2-one IUPAC Name: 8-cyclohexyl-6-methylsulfanyl-3-propyl-7H-purin-2-one Traditional Name: 8-cyclohexyl-6-(methylthio)-3-propyl-7H-purin-2-one Formula: C15H22N4OS MolecularWeight: 306.42638

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=NC1=O)SC)NC(=N2)C3CCCCC3

Isomeric SMILES

CCCN1C2=C(C(=NC1=O)SC)NC(=N2)C3CCCCC3

InChI

InChI=1S/C15H22N4OS/c1-3-9-19-13-11(14(21-2)18-15(19)20)16-12(17-13)10-7-5-4-6-8-10/h10H,3-9H2,1-2H3,(H,16,17)