2-methylsulfanyl-5-nonyl-4-oxidanyl-1H-pyrimidin-6-one

Systemtic Name: 2-methylsulfanyl-5-nonyl-4-oxidanyl-1H-pyrimidin-6-one Openeye Name: 4-hydroxy-2-methylsulfanyl-5-nonyl-1H-pyrimidin-6-one CAS Name: 4-hydroxy-2-(methylthio)-5-nonyl-1H-pyrimidin-6-one IUPAC Name: 4-hydroxy-2-methylsulfanyl-5-nonyl-1H-pyrimidin-6-one Traditional Name: 4-hydroxy-2-(methylthio)-5-nonyl-1H-pyrimidin-6-one Formula: C14H24N2O2S MolecularWeight: 284.41756

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=C(N=C(NC1=O)SC)O

Isomeric SMILES

CCCCCCCCCC1=C(N=C(NC1=O)SC)O

InChI

InChI=1S/C14H24N2O2S/c1-3-4-5-6-7-8-9-10-11-12(17)15-14(19-2)16-13(11)18/h3-10H2,1-2H3,(H2,15,16,17,18)