2-ethylsulfanyl-5-octyl-4-oxidanyl-1H-pyrimidin-6-one

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(N=C(NC1=O)SCC)O

Isomeric SMILES

CCCCCCCCC1=C(N=C(NC1=O)SCC)O

InChI

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